3-[2-methyl-4-oxo-1-(2-oxo-2-phenylethyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]propanenitrile
Chemical Structure Depiction of
3-[2-methyl-4-oxo-1-(2-oxo-2-phenylethyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]propanenitrile
3-[2-methyl-4-oxo-1-(2-oxo-2-phenylethyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]propanenitrile
Compound characteristics
Compound ID: | D718-0739F |
Compound Name: | 3-[2-methyl-4-oxo-1-(2-oxo-2-phenylethyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl]propanenitrile |
Molecular Weight: | 370.41 |
Molecular Formula: | C22 H18 N4 O2 |
Smiles: | CC1=C(CCC#N)C(n2c3ccccc3nc2N1CC(c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.4181 |
logD: | 2.4181 |
logSw: | -2.4578 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 56.478 |
InChI Key: | PQNGUMDVHGOPQD-UHFFFAOYSA-N |