N-[(4-methylphenyl)methyl]-2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)pyridine-3-carboxamide
N-[(4-methylphenyl)methyl]-2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K781-3613 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)pyridine-3-carboxamide |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C25 H27 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSc1c(cccn1)C(NCc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2262 |
| logD: | 5.2262 |
| logSw: | -4.9392 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.709 |
| InChI Key: | YIPANLPDLNPSMX-UHFFFAOYSA-N |