5-(methanesulfonyl)-N-[(4-methoxyphenyl)methyl]-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
5-(methanesulfonyl)-N-[(4-methoxyphenyl)methyl]-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
5-(methanesulfonyl)-N-[(4-methoxyphenyl)methyl]-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0580 |
| Compound Name: | 5-(methanesulfonyl)-N-[(4-methoxyphenyl)methyl]-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C20 H24 N2 O5 S |
| Smiles: | Cc1ccc2c(c1)N(CCC(C(NCc1ccc(cc1)OC)=O)O2)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2561 |
| logD: | 2.2561 |
| logSw: | -2.8151 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.51 |
| InChI Key: | FDMCHZYDLCIYBM-LJQANCHMSA-N |