1-(4-methoxy-2-methyl-phenyl)-propan-1-ol | 53773-75-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-(4-methoxy-2-methyl-phenyl)-propan-1-ol
• 英文别名: α-Oxy-α-(4-methoxy-2-methyl-phenyl)-propan；2¹-Oxy-5-methoxy-1-methyl-2-propyl-benzol；1-(4-Methoxy-2-methylphenyl)-1-propanol；1-(4-methoxy-2-methylphenyl)propan-1-ol
• CAS: 53773-75-4
• 化学式: C₁₁H₁₆O₂
• 分子量: 180.247
• InChiKey: GEQFDNVMYBRGEC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(4-methoxy-2-methyl-phenyl)-propan-1-ol 生成 3-甲基-4-丙烯基-苯甲醚
  参考文献：
  名称：

  Antifungal Pharmacodynamic Characteristics of Amphotericin B againstTrichosporon asahii, Using Time-Kill Methodology

  摘要：

  AbstractWe determined the MIC of amphotericin B against 45 Trichosporon asahii isolates from various clinical and environmental sources, and used in vitro time‐kill methods to characterize the relationship between amphotericin B concentrations and MIC for four representative T. asahii isolates. Amphotericin B had concentration‐dependent antifungal activity. MICs ranged from 0.5 to 16 μg/ml, and most T. asahii isolates (76%, 34/45) were inhibited at safely achievable amphotericin B serum concentrations (≤ 2 μg/ml). However, 40% (18/45) of isolates were not killed at these concentrations (MFCs from 1.0 to 32 μg/ml). At concentrations ≥ 2 × MIC, amphotericin B exhibited fungicidal activity (< 99.9% reduction in CFU) over a 12‐hr time‐period; the maximal effect was achieved at ≥ 4 × MIC. Susceptibility testing confirmed the resistance of T. asahii to amphotericin B, and in vitro pharmacodynamic results also suggest that amphotericin B is not suitable therapy for T. asahii infection.

  DOI：

  10.1111/j.1348-0421.2002.tb02663.x
• 作为产物：
  描述：

  间甲基苯甲醚 在 三氯化铝 、 乙醇 、 sodium 、 Petroleum ether 作用下， 生成 1-(4-methoxy-2-methyl-phenyl)-propan-1-ol
  参考文献：
  名称：

  Antifungal Pharmacodynamic Characteristics of Amphotericin B againstTrichosporon asahii, Using Time-Kill Methodology

  摘要：

  AbstractWe determined the MIC of amphotericin B against 45 Trichosporon asahii isolates from various clinical and environmental sources, and used in vitro time‐kill methods to characterize the relationship between amphotericin B concentrations and MIC for four representative T. asahii isolates. Amphotericin B had concentration‐dependent antifungal activity. MICs ranged from 0.5 to 16 μg/ml, and most T. asahii isolates (76%, 34/45) were inhibited at safely achievable amphotericin B serum concentrations (≤ 2 μg/ml). However, 40% (18/45) of isolates were not killed at these concentrations (MFCs from 1.0 to 32 μg/ml). At concentrations ≥ 2 × MIC, amphotericin B exhibited fungicidal activity (< 99.9% reduction in CFU) over a 12‐hr time‐period; the maximal effect was achieved at ≥ 4 × MIC. Susceptibility testing confirmed the resistance of T. asahii to amphotericin B, and in vitro pharmacodynamic results also suggest that amphotericin B is not suitable therapy for T. asahii infection.

  DOI：

  10.1111/j.1348-0421.2002.tb02663.x

文献信息

• Ring-substituted 1,2-dialkylated 1,2-bis(hydroxyphenyl)ethanes. 1. Synthesis and estrogen receptor binding affinity of 2,2'- and 3,3'-disubstituted hexestrols
  作者：Rolf W. Hartmann、Walter Schwarz、Helmut Schoenenberger

  DOI：10.1021/jm00362a010

  日期：1983.8

  diastereomers. The binding affinity of these compounds to the calf uterine estrogen receptor was measured relative to that of [3H]estradiol by a competitive binding assay. All test compounds showed relative binding affinity (RBA) values between 32 and less than 0.01% that of estradiol. Only meso-3,4-bis(2,4-dihydroxyphenyl)hexane (16) showed an estrogen receptor binding affinity comparable to that

  描述了对称的3,3'-和2,2'-双取代的内消旋己烯醇衍生物的合成[3,3'-取代基：OH（1），F（2），Cl（3），Br（4），I （5），CH2N（CH3）2（6），CH3（7），CH2OCH3（8），CH2OC2H5（9），CH2OH（10），NO2（11），NH2（12），N（CH3）2（13 ），COCH3（14）和C2H5（15）；2,2'-取代基：OH（16），F（17），Cl（18），Br（19），CH3（20）和C2H5（21）]。1-3的合成是通过将苯乙酮与TiCl4 / Zn还原偶联并随后将顺式3,4-二苯基己基-3-烯氢化而完成的。通过取代己烯雌酚获得化合物4-15，而通过将1-苯基-1-丙醇与TiCl3 / LiAlH4偶联并分离内消旋非对映异构体来合成化合物16-21。通过竞争性结合测定法测量了这些化合物对小牛子宫雌激素受体的结合亲和力与[3H]雌二醇的结合亲
• HARTMANN, R. W.;SCHWARZ, W.;SCHOENENBERGER, H., J. MED. CHEM., 1983, 26, N 8, 1137-1144
  作者：HARTMANN, R. W.、SCHWARZ, W.、SCHOENENBERGER, H.

  DOI：——

  日期：——
• US8044073B2
  申请人：——

  公开号：US8044073B2

  公开（公告）日：2011-10-25
• Antifungal Pharmacodynamic Characteristics of Amphotericin B against<i>Trichosporon asahii</i>, Using Time-Kill Methodology
  作者：Yoshimi Toriumi、Takashi Sugita、Masamitsu Nakajima、Toshiharu Matsushima、Takako Shinoda

  DOI：10.1111/j.1348-0421.2002.tb02663.x

  日期：2002.2

  AbstractWe determined the MIC of amphotericin B against 45 Trichosporon asahii isolates from various clinical and environmental sources, and used in vitro time‐kill methods to characterize the relationship between amphotericin B concentrations and MIC for four representative T. asahii isolates. Amphotericin B had concentration‐dependent antifungal activity. MICs ranged from 0.5 to 16 μg/ml, and most T. asahii isolates (76%, 34/45) were inhibited at safely achievable amphotericin B serum concentrations (≤ 2 μg/ml). However, 40% (18/45) of isolates were not killed at these concentrations (MFCs from 1.0 to 32 μg/ml). At concentrations ≥ 2 × MIC, amphotericin B exhibited fungicidal activity (< 99.9% reduction in CFU) over a 12‐hr time‐period; the maximal effect was achieved at ≥ 4 × MIC. Susceptibility testing confirmed the resistance of T. asahii to amphotericin B, and in vitro pharmacodynamic results also suggest that amphotericin B is not suitable therapy for T. asahii infection.