4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-[(oxolan-2-yl)methyl]benzamide
4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V024-5297 |
| Compound Name: | 4-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-ethylpyrimidin-2-yl)sulfanyl]methyl}-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 550.72 |
| Molecular Formula: | C30 H38 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccc(cc1)C(NCC1CCCO1)=O)N(C)CCc1ccc(c(c1)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2195 |
| logD: | 4.215 |
| logSw: | -4.222 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.48 |
| InChI Key: | IHTGVMWDJDPOOX-RUZDIDTESA-N |