2-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide--hydrogen chloride (1/1)
2-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y502-5151 |
| Compound Name: | 2-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide--hydrogen chloride (1/1) |
| Molecular Weight: | 430.91 |
| Molecular Formula: | C15 H22 N8 O3 S |
| Salt: | HCl |
| Smiles: | CCn1c(C)c(cn1)NC(NNC(CCn1c(C)c(c(C)n1)[N+]([O-])=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 0.0161 |
| logD: | 0.0016 |
| logSw: | -2.1451 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.491 |
| InChI Key: | VAKWDBKGUIDDJW-UHFFFAOYSA-N |