N-(2-methyl-5-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(2-methyl-5-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(2-methyl-5-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1525 |
| Compound Name: | N-(2-methyl-5-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C21 H23 N3 O5 S2 |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NCCc1ccc(cc1)S(N)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.939 |
| logD: | 0.9338 |
| logSw: | -2.2167 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 107.119 |
| InChI Key: | ONQOSPOSOXSMGX-UHFFFAOYSA-N |