3-chloro-N-methyl-N-(3-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-chloro-N-methyl-N-(3-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-chloro-N-methyl-N-(3-methylphenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0196 |
| Compound Name: | 3-chloro-N-methyl-N-(3-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: | Cc1cccc(c1)N(C)S(c1cc2C(Nc3ccccc3Oc2cc1[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2041 |
| logD: | 4.9841 |
| logSw: | -5.5094 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.161 |
| InChI Key: | ZTUGRAQZGMFZPH-UHFFFAOYSA-N |