(4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone
(4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone
Compound characteristics
| Compound ID: | D233-0099 |
| Compound Name: | (4-benzylpiperazin-1-yl)(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidin-4-yl)methanone |
| Molecular Weight: | 453.01 |
| Molecular Formula: | C24 H25 Cl N4 O S |
| Smiles: | Cc1ccc(CSc2ncc(c(C(N3CCN(CC3)Cc3ccccc3)=O)n2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4348 |
| logD: | 4.4193 |
| logSw: | -4.3785 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.741 |
| InChI Key: | KUBNRJWLEUYDEG-UHFFFAOYSA-N |