1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)methanimine
Chemical Structure Depiction of
1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)methanimine
1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)methanimine
Compound characteristics
| Compound ID: | 8009-1695 |
| Compound Name: | 1-[4-(4-benzylpiperazin-1-yl)-3-nitrophenyl]-N-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)methanimine |
| Molecular Weight: | 419.49 |
| Molecular Formula: | C22 H25 N7 O2 |
| Smiles: | Cc1nnc(C)n1/N=C/c1ccc(c(c1)[N+]([O-])=O)N1CCN(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9418 |
| logD: | 1.8649 |
| logSw: | -2.5039 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.621 |
| InChI Key: | TVEFDZMNGQMNHZ-UHFFFAOYSA-N |