3-({[4-(4-acetylpiperazin-1-yl)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide
Chemical Structure Depiction of
3-({[4-(4-acetylpiperazin-1-yl)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide
3-({[4-(4-acetylpiperazin-1-yl)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide
Compound characteristics
| Compound ID: | V027-2475 |
| Compound Name: | 3-({[4-(4-acetylpiperazin-1-yl)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide |
| Molecular Weight: | 537.68 |
| Molecular Formula: | C31 H31 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)c1cc(c2ccccc2)nc(n1)SCc1cccc(c1)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7139 |
| logD: | 5.7136 |
| logSw: | -5.4677 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.513 |
| InChI Key: | ZWYFAKKGFWTAPP-UHFFFAOYSA-N |