N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxo-1-phenyl-1-[(pyridin-2-yl)sulfanyl]prop-1-en-2-yl}benzamide
Chemical Structure Depiction of
N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxo-1-phenyl-1-[(pyridin-2-yl)sulfanyl]prop-1-en-2-yl}benzamide
N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxo-1-phenyl-1-[(pyridin-2-yl)sulfanyl]prop-1-en-2-yl}benzamide
Compound characteristics
| Compound ID: | 4476-4370 |
| Compound Name: | N-{3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxo-1-phenyl-1-[(pyridin-2-yl)sulfanyl]prop-1-en-2-yl}benzamide |
| Molecular Weight: | 493.6 |
| Molecular Formula: | C25 H23 N3 O4 S2 |
| Smiles: | C1CS(CC1NC(\C(=C(/c1ccccc1)Sc1ccccn1)NC(c1ccccc1)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6436 |
| logD: | 2.2748 |
| logSw: | -3.2098 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.269 |
| InChI Key: | DZGHHVVDJRIOQR-LPNGOHTBSA-N |