3-methyl-N'-[1-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ylidene]benzohydrazide
Chemical Structure Depiction of
3-methyl-N'-[1-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ylidene]benzohydrazide
3-methyl-N'-[1-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ylidene]benzohydrazide
Compound characteristics
| Compound ID: | 8009-8411 |
| Compound Name: | 3-methyl-N'-[1-(3-nitro-1H-1,2,4-triazol-1-yl)propan-2-ylidene]benzohydrazide |
| Molecular Weight: | 302.29 |
| Molecular Formula: | C13 H14 N6 O3 |
| Smiles: | C\C(Cn1cnc(n1)[N+]([O-])=O)=N/NC(c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5525 |
| logD: | 1.5133 |
| logSw: | -2.2885 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.59 |
| InChI Key: | ANUXFHRXEWNQGS-UHFFFAOYSA-N |