3-({[4-chloro-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(2,4-dichlorophenyl)ethyl]benzamide
Chemical Structure Depiction of
3-({[4-chloro-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(2,4-dichlorophenyl)ethyl]benzamide
3-({[4-chloro-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(2,4-dichlorophenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | V014-9095 |
| Compound Name: | 3-({[4-chloro-6-(pyrrolidin-1-yl)pyrimidin-2-yl]sulfanyl}methyl)-N-[2-(2,4-dichlorophenyl)ethyl]benzamide |
| Molecular Weight: | 521.9 |
| Molecular Formula: | C24 H23 Cl3 N4 O S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)c1cc(nc(n1)SCc1cccc(c1)C(NCCc1ccc(cc1[Cl])[Cl])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.7479 |
| logD: | 6.7479 |
| logSw: | -6.6248 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.664 |
| InChI Key: | OOQUGOPYKCUTSH-UHFFFAOYSA-N |