N'-tert-butyl-N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
N'-tert-butyl-N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Compound characteristics
| Compound ID: | V005-7857 |
| Compound Name: | N'-tert-butyl-N-{2-[3-(2-chlorophenyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea |
| Molecular Weight: | 488.99 |
| Molecular Formula: | C25 H30 Cl F N4 O3 |
| Smiles: | CC(C)(C)NC(N(CCOC)CC(N1C(CC(c2ccccc2[Cl])=N1)c1ccccc1F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.729 |
| logD: | 4.7289 |
| logSw: | -4.8202 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.629 |
| InChI Key: | XIIKYFGKUBMIQV-JOCHJYFZSA-N |