4-chloro-N-[(2-chlorophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-chloro-N-[(2-chlorophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
4-chloro-N-[(2-chlorophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-0154 |
| Compound Name: | 4-chloro-N-[(2-chlorophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 343.23 |
| Molecular Formula: | C13 H12 Cl2 N4 O S |
| Smiles: | Cc1c(c(C(NC(Nc2ccccc2[Cl])=S)=O)n(C)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.888 |
| logD: | 2.8563 |
| logSw: | -3.7488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.411 |
| InChI Key: | IDJIMBRFAPOPQL-UHFFFAOYSA-N |