N-(2,4-dimethylpentan-3-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylpentan-3-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N-(2,4-dimethylpentan-3-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0102 |
| Compound Name: | N-(2,4-dimethylpentan-3-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 368.49 |
| Molecular Formula: | C18 H28 N2 O4 S |
| Smiles: | CC(C)C(C(C)C)NC(C1CCN(c2ccccc2O1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4799 |
| logD: | 3.4799 |
| logSw: | -3.8404 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.59 |
| InChI Key: | OSIXRRZRILXBQI-MRXNPFEDSA-N |