(4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone
(4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone
Compound characteristics
| Compound ID: | D233-0038 |
| Compound Name: | (4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C23 H22 Cl F N4 O S |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(c1c(cnc(n1)SCc1ccc(cc1)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0405 |
| logD: | 4.0249 |
| logSw: | -4.2115 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.741 |
| InChI Key: | AAHLJKLOBXIZSN-UHFFFAOYSA-N |