N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-4-yl}-N'-ethylthiourea
Chemical Structure Depiction of
N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-4-yl}-N'-ethylthiourea
N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-4-yl}-N'-ethylthiourea
Compound characteristics
| Compound ID: | Y508-5098 |
| Compound Name: | N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-4-yl}-N'-ethylthiourea |
| Molecular Weight: | 339.25 |
| Molecular Formula: | C13 H15 Br N4 S |
| Smiles: | CCNC(Nc1cnn(Cc2ccc(cc2)[Br])c1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.6099 |
| logD: | 2.6099 |
| logSw: | -2.6348 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 34.786 |
| InChI Key: | AVUUXKYQFMBZEN-UHFFFAOYSA-N |