4-chloro-1-methyl-N-[(morpholin-4-yl)carbamothioyl]-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-chloro-1-methyl-N-[(morpholin-4-yl)carbamothioyl]-1H-pyrazole-5-carboxamide
4-chloro-1-methyl-N-[(morpholin-4-yl)carbamothioyl]-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y509-0073 |
| Compound Name: | 4-chloro-1-methyl-N-[(morpholin-4-yl)carbamothioyl]-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 303.77 |
| Molecular Formula: | C10 H14 Cl N5 O2 S |
| Smiles: | Cn1c(C(NC(NN2CCOCC2)=S)=O)c(cn1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 0.1883 |
| logD: | 0.1863 |
| logSw: | -2.6207 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.626 |
| InChI Key: | JSAYBFHLTCZOHI-UHFFFAOYSA-N |