6-iodo-3-(4-methylphenyl)-2-[(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
6-iodo-3-(4-methylphenyl)-2-[(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
6-iodo-3-(4-methylphenyl)-2-[(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Compound characteristics
Compound ID: | 3966-0027 |
Compound Name: | 6-iodo-3-(4-methylphenyl)-2-[(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one |
Molecular Weight: | 547.39 |
Molecular Formula: | C27 H22 I N3 O2 |
Smiles: | CCCN1C(C(=C\C2=Nc3ccc(cc3C(N2c2ccc(C)cc2)=O)I)\c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 6.1675 |
logD: | 6.1675 |
logSw: | -5.5429 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.313 |
InChI Key: | ZNKFURKFGAUKJE-UHFFFAOYSA-N |