2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)-N-(4-methylphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)-N-(4-methylphenyl)hydrazine-1-carbothioamide
2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)-N-(4-methylphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y501-8229 |
| Compound Name: | 2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)-N-(4-methylphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 348.38 |
| Molecular Formula: | C14 H16 N6 O3 S |
| Smiles: | Cc1ccc(cc1)NC(NNC(c1c(c(C)nn1C)[N+]([O-])=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 1.4275 |
| logD: | -0.4179 |
| logSw: | -2.4104 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.814 |
| InChI Key: | DXLFDHJYVMLRPD-UHFFFAOYSA-N |