5-(methanesulfonyl)-N-(4-methoxyphenyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
5-(methanesulfonyl)-N-(4-methoxyphenyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
5-(methanesulfonyl)-N-(4-methoxyphenyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0548 |
| Compound Name: | 5-(methanesulfonyl)-N-(4-methoxyphenyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C19 H22 N2 O5 S |
| Smiles: | Cc1ccc2c(c1)N(CCC(C(Nc1ccc(cc1)OC)=O)O2)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7388 |
| logD: | 2.7388 |
| logSw: | -3.4509 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.188 |
| InChI Key: | VFCYTGJFFRQIGL-GOSISDBHSA-N |