N-[(1,3-dimethyl-1H-pyrazol-5-yl)carbamothioyl]-3-(1-ethyl-1H-pyrazol-4-yl)prop-2-enamide
Chemical Structure Depiction of
N-[(1,3-dimethyl-1H-pyrazol-5-yl)carbamothioyl]-3-(1-ethyl-1H-pyrazol-4-yl)prop-2-enamide
N-[(1,3-dimethyl-1H-pyrazol-5-yl)carbamothioyl]-3-(1-ethyl-1H-pyrazol-4-yl)prop-2-enamide
Compound characteristics
| Compound ID: | Y503-4629 |
| Compound Name: | N-[(1,3-dimethyl-1H-pyrazol-5-yl)carbamothioyl]-3-(1-ethyl-1H-pyrazol-4-yl)prop-2-enamide |
| Molecular Weight: | 318.4 |
| Molecular Formula: | C14 H18 N6 O S |
| Smiles: | CCn1cc(/C=C/C(NC(Nc2cc(C)nn2C)=S)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 0.796 |
| logD: | 0.7936 |
| logSw: | -2.2673 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.191 |
| InChI Key: | OXZOQLZISJGNHU-UHFFFAOYSA-N |