N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-oxo-5-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-oxo-5-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-oxo-5-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl]propanamide
Compound characteristics
| Compound ID: | K279-0668 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2-oxo-5-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-2,3-dihydroimidazo[1,2-c]quinazolin-3-yl]propanamide |
| Molecular Weight: | 597.69 |
| Molecular Formula: | C32 H31 N5 O5 S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSC1=Nc2ccccc2C2=NC(C(CCC(NCc3ccc4c(c3)OCO4)=O)N12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3196 |
| logD: | 4.3189 |
| logSw: | -4.2667 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.888 |
| InChI Key: | JFPOJZYPDLOKJU-VWLOTQADSA-N |