N'-tert-butyl-N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
N'-tert-butyl-N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Compound characteristics
| Compound ID: | V027-3419 |
| Compound Name: | N'-tert-butyl-N-{2-[5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea |
| Molecular Weight: | 514.6 |
| Molecular Formula: | C27 H35 F N4 O5 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CCOC)CC(N1C(CC(c2ccc(cc2)F)=N1)c1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8662 |
| logD: | 3.8662 |
| logSw: | -4.0345 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.89 |
| InChI Key: | OQAPHYGGXLGEFP-JOCHJYFZSA-N |