N-[(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzamide
N-[(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | 8020-6343 |
| Compound Name: | N-[(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzamide |
| Molecular Weight: | 249.29 |
| Molecular Formula: | C10 H11 N5 O S |
| Smiles: | C(c1nnc(n1N)S)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2155 |
| logD: | -0.9279 |
| logSw: | -1.6352 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 66.546 |
| InChI Key: | YJXIZGOPJQPLKK-UHFFFAOYSA-N |