N-(2-methoxyethyl)-N-{2-[5-(1-methyl-1H-pyrrol-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N'-[4-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-(2-methoxyethyl)-N-{2-[5-(1-methyl-1H-pyrrol-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N'-[4-(trifluoromethyl)phenyl]urea
N-(2-methoxyethyl)-N-{2-[5-(1-methyl-1H-pyrrol-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N'-[4-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | V029-7705 |
| Compound Name: | N-(2-methoxyethyl)-N-{2-[5-(1-methyl-1H-pyrrol-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N'-[4-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 533.57 |
| Molecular Formula: | C25 H26 F3 N5 O3 S |
| Salt: | not_available |
| Smiles: | Cn1cccc1C1CC(c2cccs2)=NN1C(CN(CCOC)C(Nc1ccc(cc1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7829 |
| logD: | 4.7829 |
| logSw: | -4.4272 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.647 |
| InChI Key: | WJGNKLWJTTXIML-OAQYLSRUSA-N |