N'-tert-butyl-N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
N'-tert-butyl-N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Compound characteristics
| Compound ID: | V005-1304 |
| Compound Name: | N'-tert-butyl-N-{2-[5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea |
| Molecular Weight: | 460.57 |
| Molecular Formula: | C23 H29 F N4 O3 S |
| Smiles: | CC(C)(C)NC(N(CCOC)CC(N1C(CC(c2cccs2)=N1)c1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0391 |
| logD: | 4.039 |
| logSw: | -4.0048 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.647 |
| InChI Key: | JTHKSUWGILILCB-LJQANCHMSA-N |