N-{4-bromo-1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-N'-(naphthalen-1-yl)thiourea
Chemical Structure Depiction of
N-{4-bromo-1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-N'-(naphthalen-1-yl)thiourea
N-{4-bromo-1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-N'-(naphthalen-1-yl)thiourea
Compound characteristics
| Compound ID: | Y501-7174 |
| Compound Name: | N-{4-bromo-1-[(4-methylphenyl)methyl]-1H-pyrazol-3-yl}-N'-(naphthalen-1-yl)thiourea |
| Molecular Weight: | 451.39 |
| Molecular Formula: | C22 H19 Br N4 S |
| Smiles: | Cc1ccc(Cn2cc(c(NC(Nc3cccc4ccccc34)=S)n2)[Br])cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6565 |
| logD: | 5.6565 |
| logSw: | -6.7283 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 33.013 |
| InChI Key: | XMGKJZMXVWSNTP-UHFFFAOYSA-N |