4-chloro-N-[(3-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-chloro-N-[(3-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
4-chloro-N-[(3-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-9762 |
| Compound Name: | 4-chloro-N-[(3-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 338.81 |
| Molecular Formula: | C14 H15 Cl N4 O2 S |
| Smiles: | Cc1c(c(C(NC(Nc2cccc(c2)OC)=S)=O)n(C)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.6624 |
| logD: | 2.6603 |
| logSw: | -3.9209 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.652 |
| InChI Key: | NXZFDXOORDLROU-UHFFFAOYSA-N |