2-(4-chlorophenyl)-5-nitro-3-oxo-N-[(pyridin-2-yl)methyl]-2H-1lambda~5~,2,3-triazol-4-amine
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-nitro-3-oxo-N-[(pyridin-2-yl)methyl]-2H-1lambda~5~,2,3-triazol-4-amine
2-(4-chlorophenyl)-5-nitro-3-oxo-N-[(pyridin-2-yl)methyl]-2H-1lambda~5~,2,3-triazol-4-amine
Compound characteristics
| Compound ID: | C301-0585 |
| Compound Name: | 2-(4-chlorophenyl)-5-nitro-3-oxo-N-[(pyridin-2-yl)methyl]-2H-1lambda~5~,2,3-triazol-4-amine |
| Molecular Weight: | 346.73 |
| Molecular Formula: | C14 H11 Cl N6 O3 |
| Smiles: | C(c1ccccn1)Nc1c(nn(c2ccc(cc2)[Cl])[n+]1[O-])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2508 |
| logD: | 2.2498 |
| logSw: | -3.0022 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.949 |
| InChI Key: | AIDLCHFBZBDMJV-UHFFFAOYSA-N |