4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide
4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G017-0220 |
| Compound Name: | 4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C24 H30 N4 O4 S |
| Smiles: | C1CC(Nc2ccc(cc2C1)S(NCC1CCC(CC1)C(NCc1ccccn1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.138 |
| logD: | 2.1378 |
| logSw: | -2.8379 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.297 |
| InChI Key: | WATPAUASUYEXRI-UHFFFAOYSA-N |