2-{[(3-bromophenyl)methyl]sulfanyl}-N-(2-phenylethyl)pyridine-3-carboxamide
Chemical Structure Depiction of
2-{[(3-bromophenyl)methyl]sulfanyl}-N-(2-phenylethyl)pyridine-3-carboxamide
2-{[(3-bromophenyl)methyl]sulfanyl}-N-(2-phenylethyl)pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K845-0427 |
| Compound Name: | 2-{[(3-bromophenyl)methyl]sulfanyl}-N-(2-phenylethyl)pyridine-3-carboxamide |
| Molecular Weight: | 427.36 |
| Molecular Formula: | C21 H19 Br N2 O S |
| Smiles: | C(CNC(c1cccnc1SCc1cccc(c1)[Br])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7112 |
| logD: | 4.7112 |
| logSw: | -4.7441 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.401 |
| InChI Key: | ICSUITPMUKVYIP-UHFFFAOYSA-N |