4-chloro-N,3,5-trimethyl-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
4-chloro-N,3,5-trimethyl-1H-pyrazole-1-carbothioamide
4-chloro-N,3,5-trimethyl-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | Y508-2185 |
| Compound Name: | 4-chloro-N,3,5-trimethyl-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 203.69 |
| Molecular Formula: | C7 H10 Cl N3 S |
| Smiles: | Cc1c(c(C)n(C(NC)=S)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.2099 |
| logD: | 1.2099 |
| logSw: | -2.6974 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.8464 |
| InChI Key: | YWEJUSGHJFDEST-UHFFFAOYSA-N |