N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-(propan-2-yl)urea
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V027-2972 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-(propan-2-yl)urea |
| Molecular Weight: | 539.61 |
| Molecular Formula: | C28 H34 F N5 O5 |
| Salt: | not_available |
| Smiles: | CC(C)NC(N(CCN1CCOCC1)CC(N1C(CC(c2ccc(cc2)F)=N1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3676 |
| logD: | 2.6169 |
| logSw: | -3.4872 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.172 |
| InChI Key: | JCADUNOHYSYQBQ-XMMPIXPASA-N |