2-(4-chlorophenyl)-5-nitro-3-oxo-N-(2-phenylpropyl)-2H-1lambda~5~,2,3-triazol-4-amine
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-nitro-3-oxo-N-(2-phenylpropyl)-2H-1lambda~5~,2,3-triazol-4-amine
2-(4-chlorophenyl)-5-nitro-3-oxo-N-(2-phenylpropyl)-2H-1lambda~5~,2,3-triazol-4-amine
Compound characteristics
| Compound ID: | C301-0863 |
| Compound Name: | 2-(4-chlorophenyl)-5-nitro-3-oxo-N-(2-phenylpropyl)-2H-1lambda~5~,2,3-triazol-4-amine |
| Molecular Weight: | 373.8 |
| Molecular Formula: | C17 H16 Cl N5 O3 |
| Smiles: | CC(CNc1c(nn(c2ccc(cc2)[Cl])[n+]1[O-])[N+]([O-])=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4046 |
| logD: | 4.4046 |
| logSw: | -4.6956 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.406 |
| InChI Key: | BJRHGDQVAMMPMF-LBPRGKRZSA-N |