2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
Compound characteristics
| Compound ID: | 8012-5607 |
| Compound Name: | 2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C17 H17 N5 O3 S3 |
| Smiles: | C=CCn1c(c2cccs2)nnc1SCC(Nc1ccc(cc1)S(N)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1222 |
| logD: | 2.1211 |
| logSw: | -2.707 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.99 |
| InChI Key: | MJBDPFMUWKCKSF-UHFFFAOYSA-N |