11-methyl-N-[(4-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Chemical Structure Depiction of
11-methyl-N-[(4-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
11-methyl-N-[(4-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P619-0271 |
| Compound Name: | 11-methyl-N-[(4-methylphenyl)methyl]-10-oxo-10,11-dihydropyrido[3,2-b][1,4]benzoxazepine-8-sulfonamide |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C21 H19 N3 O4 S |
| Smiles: | Cc1ccc(CNS(c2ccc3c(c2)C(N(C)c2c(cccn2)O3)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2523 |
| logD: | 3.252 |
| logSw: | -3.708 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.691 |
| InChI Key: | TXPZHYONOVICCI-UHFFFAOYSA-N |