4-({6-bromo-2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
4-({6-bromo-2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-methoxyethyl)benzamide
4-({6-bromo-2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | K284-4168 |
| Compound Name: | 4-({6-bromo-2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 613.53 |
| Molecular Formula: | C28 H29 Br N4 O5 S |
| Smiles: | CCC(C(NCc1ccco1)=O)SC1=Nc2ccc(cc2C(N1Cc1ccc(cc1)C(NCCOC)=O)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5384 |
| logD: | 4.5384 |
| logSw: | -4.2745 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.074 |
| InChI Key: | BLVOFUIMDCVIAO-DEOSSOPVSA-N |