7-chloro-5-(methanesulfonyl)-N-[2-(piperidine-1-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
7-chloro-5-(methanesulfonyl)-N-[2-(piperidine-1-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
7-chloro-5-(methanesulfonyl)-N-[2-(piperidine-1-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-1259 |
| Compound Name: | 7-chloro-5-(methanesulfonyl)-N-[2-(piperidine-1-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 491.99 |
| Molecular Formula: | C23 H26 Cl N3 O5 S |
| Smiles: | CS(N1CCC(C(Nc2ccccc2C(N2CCCCC2)=O)=O)Oc2ccc(cc12)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1759 |
| logD: | 3.1705 |
| logSw: | -3.7602 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.595 |
| InChI Key: | ARZDKROGFRZQAI-OAQYLSRUSA-N |