2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]pyridine-3-carboxamide
2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K845-0078 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]pyridine-3-carboxamide |
| Molecular Weight: | 405.95 |
| Molecular Formula: | C20 H24 Cl N3 O2 S |
| Smiles: | C(CNC(c1cccnc1SCc1ccccc1[Cl])=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.921 |
| logD: | 2.5327 |
| logSw: | -3.6625 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.292 |
| InChI Key: | XEGUEDNDCOTZOA-UHFFFAOYSA-N |