N-benzyl-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
Chemical Structure Depiction of
N-benzyl-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
N-benzyl-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
Compound characteristics
| Compound ID: | 8018-2386 |
| Compound Name: | N-benzyl-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide |
| Molecular Weight: | 269.26 |
| Molecular Formula: | C12 H11 N7 O |
| Smiles: | C(c1ccccc1)NC(c1nc([nH]n1)n1cnnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2418 |
| logD: | 0.1717 |
| logSw: | -1.6156 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.667 |
| InChI Key: | AZBBLQZMHGWRQK-UHFFFAOYSA-N |