N-(2H-1,3-benzodioxol-5-yl)-2-({3-[2-(benzylamino)-2-oxoethyl]-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}sulfanyl)butanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-({3-[2-(benzylamino)-2-oxoethyl]-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}sulfanyl)butanamide
N-(2H-1,3-benzodioxol-5-yl)-2-({3-[2-(benzylamino)-2-oxoethyl]-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}sulfanyl)butanamide
Compound characteristics
| Compound ID: | K279-1287 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-({3-[2-(benzylamino)-2-oxoethyl]-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}sulfanyl)butanamide |
| Molecular Weight: | 569.64 |
| Molecular Formula: | C30 H27 N5 O5 S |
| Smiles: | CCC(C(Nc1ccc2c(c1)OCO2)=O)SC1=Nc2ccccc2C2=NC(C(CC(NCc3ccccc3)=O)N12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5482 |
| logD: | 3.5456 |
| logSw: | -3.869 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.101 |
| InChI Key: | RJVDDZWCKVBKJA-UHFFFAOYSA-N |