N-[(3-methoxyphenyl)carbamothioyl]-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)carbamothioyl]-1-methyl-1H-pyrazole-3-carboxamide
N-[(3-methoxyphenyl)carbamothioyl]-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y508-6972 |
| Compound Name: | N-[(3-methoxyphenyl)carbamothioyl]-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 290.34 |
| Molecular Formula: | C13 H14 N4 O2 S |
| Smiles: | Cn1ccc(C(NC(Nc2cccc(c2)OC)=S)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.8003 |
| logD: | 1.8003 |
| logSw: | -2.5281 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.476 |
| InChI Key: | AGJUJWVDEMPVRX-UHFFFAOYSA-N |