8-chloro-N-methyl-N-(2-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
8-chloro-N-methyl-N-(2-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
8-chloro-N-methyl-N-(2-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0034 |
| Compound Name: | 8-chloro-N-methyl-N-(2-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 428.89 |
| Molecular Formula: | C21 H17 Cl N2 O4 S |
| Smiles: | Cc1ccccc1N(C)S(c1ccc2c(c1)C(Nc1cc(ccc1O2)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9583 |
| logD: | 4.1299 |
| logSw: | -4.9546 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.86 |
| InChI Key: | SMNIRLYMLBUUFK-UHFFFAOYSA-N |