2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(3-methoxyphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(3-methoxyphenyl)hydrazine-1-carbothioamide
2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(3-methoxyphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y501-8221 |
| Compound Name: | 2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]-N-(3-methoxyphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C16 H20 N6 O4 S |
| Smiles: | CC(C(NNC(Nc1cccc(c1)OC)=S)=O)n1c(C)c(c(C)n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5744 |
| logD: | 1.5614 |
| logSw: | -2.503 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102.131 |
| InChI Key: | VBQVRAKEPFEYAU-NSHDSACASA-N |