3-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methylphenyl)propanamide
Chemical Structure Depiction of
3-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methylphenyl)propanamide
3-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methylphenyl)propanamide
Compound characteristics
Compound ID: | F797-0134 |
Compound Name: | 3-(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-methylphenyl)propanamide |
Molecular Weight: | 360.41 |
Molecular Formula: | C21 H20 N4 O2 |
Smiles: | Cc1ccc(cc1)NC(CCN1C=Nc2c3cc(C)ccc3[nH]c2C1=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0593 |
logD: | 3.0593 |
logSw: | -3.3178 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.425 |
InChI Key: | QJWBGRKEGWMYIT-UHFFFAOYSA-N |