3-chloro-N-(4-methoxyphenyl)-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-chloro-N-(4-methoxyphenyl)-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-chloro-N-(4-methoxyphenyl)-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0190 |
| Compound Name: | 3-chloro-N-(4-methoxyphenyl)-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 444.89 |
| Molecular Formula: | C21 H17 Cl N2 O5 S |
| Smiles: | CN(c1ccc(cc1)OC)S(c1cc2C(Nc3ccccc3Oc2cc1[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7091 |
| logD: | 4.4891 |
| logSw: | -4.9739 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.705 |
| InChI Key: | VMBMQHRCZRZMLA-UHFFFAOYSA-N |