4-bromo-N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethyl-1H-pyrazole-3-carboxamide
4-bromo-N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-1392 |
| Compound Name: | 4-bromo-N-[(2-bromo-4-methylphenyl)carbamothioyl]-1-ethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 446.16 |
| Molecular Formula: | C14 H14 Br2 N4 O S |
| Smiles: | CCn1cc(c(C(NC(Nc2ccc(C)cc2[Br])=S)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9325 |
| logD: | 3.926 |
| logSw: | -3.7552 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.59 |
| InChI Key: | SDGQAIZCRGKMMA-UHFFFAOYSA-N |