N-(1-benzyl-1H-benzimidazol-2-yl)-5-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(1-benzyl-1H-benzimidazol-2-yl)-5-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]furan-2-carboxamide
N-(1-benzyl-1H-benzimidazol-2-yl)-5-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | 6228-1590 |
| Compound Name: | N-(1-benzyl-1H-benzimidazol-2-yl)-5-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 443.42 |
| Molecular Formula: | C22 H17 N7 O4 |
| Smiles: | C(c1ccccc1)n1c2ccccc2nc1NC(c1ccc(Cn2cnc(n2)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7697 |
| logD: | 3.7696 |
| logSw: | -4.186 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.403 |
| InChI Key: | QLHBXQWEXYITSV-UHFFFAOYSA-N |