N'-tert-butyl-N-methyl-N-{2-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}urea
Chemical Structure Depiction of
N'-tert-butyl-N-methyl-N-{2-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}urea
N'-tert-butyl-N-methyl-N-{2-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}urea
Compound characteristics
| Compound ID: | V005-7824 |
| Compound Name: | N'-tert-butyl-N-methyl-N-{2-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}urea |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C22 H28 N4 O2 S |
| Smiles: | Cc1ccc(cc1)C1CC(c2cccs2)=NN1C(CN(C)C(NC(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3848 |
| logD: | 4.3848 |
| logSw: | -4.21 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.266 |
| InChI Key: | JZSLCWRKDBKQNL-GOSISDBHSA-N |