2-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide
2-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-5034 |
| Compound Name: | 2-{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbonyl}-N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)hydrazine-1-carbothioamide |
| Molecular Weight: | 401.49 |
| Molecular Formula: | C18 H23 N7 O2 S |
| Smiles: | CCn1c(C)c(cn1)NC(NNC(c1ccc(Cn2c(C)cc(C)n2)o1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 0.9705 |
| logD: | 0.9626 |
| logSw: | -2.3007 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.97 |
| InChI Key: | RUBUAMUFJWCKEU-UHFFFAOYSA-N |