N-(3,4-dichlorophenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
N-(3,4-dichlorophenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M179-0077 |
| Compound Name: | N-(3,4-dichlorophenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 383.3 |
| Molecular Formula: | C16 H16 Cl2 N4 O S |
| Smiles: | C1CCN(C1)c1cc(ncn1)SCC(Nc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8773 |
| logD: | 4.8681 |
| logSw: | -5.0134 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.569 |
| InChI Key: | QNWNYGSSGXMODB-UHFFFAOYSA-N |