4-{[2-{[1-(3-chloro-4-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-[(furan-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-{[2-{[1-(3-chloro-4-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-[(furan-2-yl)methyl]benzamide
4-{[2-{[1-(3-chloro-4-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-[(furan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K284-7201 |
| Compound Name: | 4-{[2-{[1-(3-chloro-4-methylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-[(furan-2-yl)methyl]benzamide |
| Molecular Weight: | 601.12 |
| Molecular Formula: | C32 H29 Cl N4 O4 S |
| Smiles: | CCC(C(Nc1ccc(C)c(c1)[Cl])=O)SC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NCc1ccco1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8142 |
| logD: | 6.8139 |
| logSw: | -6.1857 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.296 |
| InChI Key: | SGWNVTUIMIWLMF-NDEPHWFRSA-N |