2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide
Chemical Structure Depiction of
2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide
2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 6995-0189 |
| Compound Name: | 2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[5-(4-nitrobenzene-1-sulfonyl)-1,3-thiazol-2-yl]acetamide |
| Molecular Weight: | 440.48 |
| Molecular Formula: | C14 H12 N6 O5 S3 |
| Smiles: | Cn1cnnc1SCC(Nc1ncc(s1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6266 |
| logD: | 1.6231 |
| logSw: | -2.5827 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.332 |
| InChI Key: | VQFUPVQKYWKFCK-UHFFFAOYSA-N |