4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-(2-methylpropyl)benzamide
4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V024-5252 |
| Compound Name: | 4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 522.71 |
| Molecular Formula: | C29 H38 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(NCC(C)C)=O)N(C)CCc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2542 |
| logD: | 5.2497 |
| logSw: | -5.0241 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.098 |
| InChI Key: | DLJWSFKSELVWDQ-UHFFFAOYSA-N |