4-bromo-N-[(4-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-bromo-N-[(4-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
4-bromo-N-[(4-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-0130 |
| Compound Name: | 4-bromo-N-[(4-methoxyphenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 383.26 |
| Molecular Formula: | C14 H15 Br N4 O2 S |
| Smiles: | Cc1c(c(C(NC(Nc2ccc(cc2)OC)=S)=O)n(C)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.6005 |
| logD: | 2.5964 |
| logSw: | -3.1526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.652 |
| InChI Key: | YLSCQLPJKYKJLK-UHFFFAOYSA-N |