N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-3-phenyl-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-3-phenyl-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide
N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-3-phenyl-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide
Compound characteristics
Compound ID: | C336-0039 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-3-phenyl-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]butanamide |
Molecular Weight: | 498.56 |
Molecular Formula: | C27 H22 N4 O4 S |
Smiles: | CCC(C(Nc1ccc2c(c1)OCO2)=O)SC1=Nc2ccccc2C2=NC(C(c3ccccc3)N12)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.5348 |
logD: | 4.5303 |
logSw: | -4.3489 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.678 |
InChI Key: | XZPSSIWEYJMKOV-UHFFFAOYSA-N |