N-(5-chloro-2-methylphenyl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N-(5-chloro-2-methylphenyl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0108 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 394.88 |
| Molecular Formula: | C18 H19 Cl N2 O4 S |
| Smiles: | Cc1ccc(cc1NC(C1CCN(c2ccccc2O1)S(C)(=O)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0547 |
| logD: | 3.0538 |
| logSw: | -3.5738 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.946 |
| InChI Key: | FVINMXUAWJORME-KRWDZBQOSA-N |