N-{4-bromo-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-ethylthiourea
Chemical Structure Depiction of
N-{4-bromo-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-ethylthiourea
N-{4-bromo-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-ethylthiourea
Compound characteristics
| Compound ID: | Y501-7537 |
| Compound Name: | N-{4-bromo-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-N'-ethylthiourea |
| Molecular Weight: | 357.24 |
| Molecular Formula: | C13 H14 Br F N4 S |
| Smiles: | CCNC(Nc1c(cn(Cc2ccccc2F)n1)[Br])=S |
| Stereo: | ACHIRAL |
| logP: | 2.9694 |
| logD: | 2.9693 |
| logSw: | -2.9889 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.202 |
| InChI Key: | QTILJPVKLFJRAT-UHFFFAOYSA-N |