N-(5-chloro-2-methoxyphenyl)-5-(methanesulfonyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-5-(methanesulfonyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N-(5-chloro-2-methoxyphenyl)-5-(methanesulfonyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0587 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-5-(methanesulfonyl)-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 424.9 |
| Molecular Formula: | C19 H21 Cl N2 O5 S |
| Smiles: | Cc1ccc2c(c1)N(CCC(C(Nc1cc(ccc1OC)[Cl])=O)O2)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3079 |
| logD: | 3.2941 |
| logSw: | -3.736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.577 |
| InChI Key: | FPLFETZLRRBHNH-SFHVURJKSA-N |