N-[(furan-2-yl)methyl]-4-({2-[(1-{[(4-methylphenyl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-({2-[(1-{[(4-methylphenyl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide
N-[(furan-2-yl)methyl]-4-({2-[(1-{[(4-methylphenyl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | K284-7202 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-({2-[(1-{[(4-methylphenyl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide |
| Molecular Weight: | 580.71 |
| Molecular Formula: | C33 H32 N4 O4 S |
| Smiles: | CCC(C(NCc1ccc(C)cc1)=O)SC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NCc1ccco1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3646 |
| logD: | 5.3646 |
| logSw: | -5.2599 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.618 |
| InChI Key: | JIESNKBQNSJOFE-LJAQVGFWSA-N |