5-(methanesulfonyl)-N-(3-methylphenyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
5-(methanesulfonyl)-N-(3-methylphenyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
5-(methanesulfonyl)-N-(3-methylphenyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0049 |
| Compound Name: | 5-(methanesulfonyl)-N-(3-methylphenyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 360.43 |
| Molecular Formula: | C18 H20 N2 O4 S |
| Smiles: | Cc1cccc(c1)NC(C1CCN(c2ccccc2O1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6589 |
| logD: | 2.6589 |
| logSw: | -3.2328 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.644 |
| InChI Key: | ZGLVKCFZGJIHIO-QGZVFWFLSA-N |