3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V027-6415 |
| Compound Name: | 3-({[4-(4-acetylpiperazin-1-yl)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C23 H31 N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)c1c(C)c(C)nc(n1)SCc1cccc(c1)C(NCCOC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7086 |
| logD: | 2.7069 |
| logSw: | -3.1185 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.287 |
| InChI Key: | AIVWMMMQXUUYBV-UHFFFAOYSA-N |