N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-phenylethyl)thiourea
Chemical Structure Depiction of
N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-phenylethyl)thiourea
N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-phenylethyl)thiourea
Compound characteristics
| Compound ID: | Y509-0368 |
| Compound Name: | N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-N'-(2-phenylethyl)thiourea |
| Molecular Weight: | 443.41 |
| Molecular Formula: | C21 H23 Br N4 S |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)[Br])n1)NC(NCCc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.797 |
| logD: | 3.797 |
| logSw: | -4.0105 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 33.111 |
| InChI Key: | DIRXZMVDWCLIQH-UHFFFAOYSA-N |