ethyl (1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamodithioate
Chemical Structure Depiction of
ethyl (1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamodithioate
ethyl (1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamodithioate
Compound characteristics
| Compound ID: | 1189-2752 |
| Compound Name: | ethyl (1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamodithioate |
| Molecular Weight: | 307.43 |
| Molecular Formula: | C14 H17 N3 O S2 |
| Smiles: | CCSC(NC1=C(C)N(C)N(C1=O)c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 1.8779 |
| logD: | 1.2785 |
| logSw: | -2.3222 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.9257 |
| InChI Key: | RDKBXFLQARGTMS-UHFFFAOYSA-N |