5-(methanesulfonyl)-7-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
5-(methanesulfonyl)-7-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
5-(methanesulfonyl)-7-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0501 |
| Compound Name: | 5-(methanesulfonyl)-7-methyl-N-[2-(morpholine-4-carbonyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C23 H27 N3 O6 S |
| Smiles: | Cc1ccc2c(c1)N(CCC(C(Nc1ccccc1C(N1CCOCC1)=O)=O)O2)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8925 |
| logD: | 1.8872 |
| logSw: | -2.9647 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.503 |
| InChI Key: | VQEYCLXPTLQMBE-OAQYLSRUSA-N |