4-({1-[3-(dibutylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-({1-[3-(dibutylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-({1-[3-(dibutylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
Compound ID: | D009-0590 |
Compound Name: | 4-({1-[3-(dibutylamino)-2-hydroxypropyl]-1H-indol-3-yl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
Molecular Weight: | 486.66 |
Molecular Formula: | C30 H38 N4 O2 |
Smiles: | CCCCN(CCCC)CC(Cn1cc(\C=C2/C(C)=NN(C2=O)c2ccccc2)c2ccccc12)O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.4895 |
logD: | 4.1189 |
logSw: | -5.2469 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.15 |
InChI Key: | MJICQGMQLJIKBI-SANMLTNESA-N |