N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-propylurea
Chemical Structure Depiction of
N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-propylurea
N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-propylurea
Compound characteristics
Compound ID: | V026-0609 |
Compound Name: | N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]-N'-propylurea |
Molecular Weight: | 552.63 |
Molecular Formula: | C28 H36 N6 O6 |
Salt: | not_available |
Smiles: | CCCNC(N(CCN1CCOCC1)CC(N1C(CC(c2ccc(cc2)[N+]([O-])=O)=N1)c1ccc(cc1)OC)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4022 |
logD: | 2.6515 |
logSw: | -3.4133 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 105.849 |
InChI Key: | KWFDWFZTIJFSFO-AREMUKBSSA-N |