2-{[3-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
2-{[3-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}-N-[(4-methylphenyl)methyl]butanamide
2-{[3-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | K279-0783 |
| Compound Name: | 2-{[3-(3-{[(4-methoxyphenyl)methyl]amino}-3-oxopropyl)-2-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]sulfanyl}-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 597.74 |
| Molecular Formula: | C33 H35 N5 O4 S |
| Smiles: | CCC(C(NCc1ccc(C)cc1)=O)SC1=Nc2ccccc2C2=NC(C(CCC(NCc3ccc(cc3)OC)=O)N12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9754 |
| logD: | 3.9745 |
| logSw: | -4.2495 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.852 |
| InChI Key: | OTDKWNRYDVNQRZ-UHFFFAOYSA-N |