7-chloro-5-(methanesulfonyl)-N-[(oxolan-2-yl)methyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
7-chloro-5-(methanesulfonyl)-N-[(oxolan-2-yl)methyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
7-chloro-5-(methanesulfonyl)-N-[(oxolan-2-yl)methyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-1250 |
| Compound Name: | 7-chloro-5-(methanesulfonyl)-N-[(oxolan-2-yl)methyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 388.87 |
| Molecular Formula: | C16 H21 Cl N2 O5 S |
| Smiles: | CS(N1CCC(C(NCC2CCCO2)=O)Oc2ccc(cc12)[Cl])(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.2741 |
| logD: | 1.2741 |
| logSw: | -2.8527 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.621 |
| InChI Key: | WZIJUYSBTLDLNW-UHFFFAOYSA-N |