N-[1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-N'-(3-chlorophenyl)-N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}urea
Chemical Structure Depiction of
N-[1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-N'-(3-chlorophenyl)-N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}urea
N-[1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-N'-(3-chlorophenyl)-N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}urea
Compound characteristics
| Compound ID: | Y500-7563 |
| Compound Name: | N-[1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-N'-(3-chlorophenyl)-N-{1-[(4-fluorophenyl)methyl]-1H-pyrazol-4-yl}urea |
| Molecular Weight: | 590.05 |
| Molecular Formula: | C31 H29 Cl F N5 O4 |
| Smiles: | CCCCOc1ccc(cc1)N1C(CC(C1=O)N(C(Nc1cccc(c1)[Cl])=O)c1cnn(Cc2ccc(cc2)F)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4643 |
| logD: | 5.4643 |
| logSw: | -5.7606 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.15 |
| InChI Key: | MVCPHMMLGTYZEP-NDEPHWFRSA-N |