N-[2-(cyclohexylcarbamoyl)phenyl]-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohexylcarbamoyl)phenyl]-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N-[2-(cyclohexylcarbamoyl)phenyl]-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0136 |
| Compound Name: | N-[2-(cyclohexylcarbamoyl)phenyl]-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C24 H29 N3 O5 S |
| Smiles: | CS(N1CCC(C(Nc2ccccc2C(NC2CCCCC2)=O)=O)Oc2ccccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4655 |
| logD: | 3.4639 |
| logSw: | -3.9832 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.085 |
| InChI Key: | ADVMPOVBKUVKBJ-JOCHJYFZSA-N |