N-ethyl-2-[3-(3-nitro-1H-pyrazol-1-yl)propanoyl]hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-ethyl-2-[3-(3-nitro-1H-pyrazol-1-yl)propanoyl]hydrazine-1-carbothioamide
N-ethyl-2-[3-(3-nitro-1H-pyrazol-1-yl)propanoyl]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-7220 |
| Compound Name: | N-ethyl-2-[3-(3-nitro-1H-pyrazol-1-yl)propanoyl]hydrazine-1-carbothioamide |
| Molecular Weight: | 286.31 |
| Molecular Formula: | C9 H14 N6 O3 S |
| Smiles: | CCNC(NNC(CCn1ccc(n1)[N+]([O-])=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | -0.8097 |
| logD: | -1.0864 |
| logSw: | -2.0026 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.656 |
| InChI Key: | CYJSRPREOHOZJN-UHFFFAOYSA-N |