N-[2-(3,4-diethoxyphenyl)ethyl]-N'-{1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-N'-{1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
N-[2-(3,4-diethoxyphenyl)ethyl]-N'-{1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea
Compound characteristics
| Compound ID: | Y503-3961 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-N'-{1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}thiourea |
| Molecular Weight: | 442.55 |
| Molecular Formula: | C23 H27 F N4 O2 S |
| Smiles: | CCOc1ccc(CCNC(Nc2ccn(Cc3ccccc3F)n2)=S)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.5447 |
| logD: | 3.5446 |
| logSw: | -3.71 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.601 |
| InChI Key: | HKGIDABPIDDPPZ-UHFFFAOYSA-N |