2-({5-[(benzylsulfanyl)methyl]-4-(4-sulfamoylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
2-({5-[(benzylsulfanyl)methyl]-4-(4-sulfamoylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
2-({5-[(benzylsulfanyl)methyl]-4-(4-sulfamoylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y203-0245 |
| Compound Name: | 2-({5-[(benzylsulfanyl)methyl]-4-(4-sulfamoylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C18 H19 N5 O3 S3 |
| Smiles: | C(c1ccccc1)SCc1nnc(n1c1ccc(cc1)S(N)(=O)=O)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1154 |
| logD: | 1.1145 |
| logSw: | -1.9592 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.951 |
| InChI Key: | CVCRIJMPNLCVBU-UHFFFAOYSA-N |