4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate
概要:4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate(CAS 331459-78-0)是一种化学化合物,分子式为C28H22O4S,分子量为454.12 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务,支持克级到吨级规格。
[4-[4-(4-methylbenzoyl)oxyphenyl]sulfanylphenyl] 4-methylbenzoate
又称:4-({4-[(4-methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate, [4-[4-(4-methylbenzoyl)oxyphenyl]sulfanylphenyl] 4-methylbenzoate, AA-768/31128014, 4-({4-[(4-methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzenecarboxylate, 4-{[4-(4-methylbenzoyloxy)phenyl]sulfanyl}phenyl 4-methylbenzoate
| 分子式 | C28H22O4S |
|---|---|
| 分子量 | 454.12 g/mol |
| LogP | 6.89304 |
| 拓扑极性表面积 | 52.6 Ų |
| 氢键供体数 | 0 |
| 氢键受体数 | 5 |
| 可旋转键数 | 6 |
| 精确质量 | 454.12387 |
| 重原子数 | 33 |
| 复杂度 | 1142.5541 |
化学标识符
| CAS 编号 | 331459-78-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)SC3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)C |
产品概述
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate(CAS 331459-78-0),分子式为C28H22O4S,分子量为454.12 g/mol。IUPAC名:[4-[4-(4-methylbenzoyl)oxyphenyl]sulfanylphenyl] 4-methylbenzoate。
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate化学性质概览
属性洞察:4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的XLogP值为6.89304,表明该化合物具有亲脂性(脂溶性好),可能影响其吸收、分布和配方策略。 4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的拓扑极性表面积(TPSA)为52.6 Ų,极性较低,可能具有较好的细胞膜透过性。 根据Lipinski五规则,4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate有0个氢键供体和5个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的CAS号是多少?
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的CAS号为331459-78-0。
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的分子式是什么?
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的分子式为C28H22O4S。
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的分子量是多少?
4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate的分子量为454.12 g/mol。
在哪里可以购买4-({4-[(4-Methylbenzoyl)oxy]phenyl}sulfanyl)phenyl 4-methylbenzoate?
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