4-butoxy-N-[6-iodo-2-(4-methoxy-3-{[(pyridin-2-yl)sulfanyl]methyl}phenyl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzamide
Chemical Structure Depiction of
4-butoxy-N-[6-iodo-2-(4-methoxy-3-{[(pyridin-2-yl)sulfanyl]methyl}phenyl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzamide
4-butoxy-N-[6-iodo-2-(4-methoxy-3-{[(pyridin-2-yl)sulfanyl]methyl}phenyl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzamide
Compound characteristics
| Compound ID: | Y500-5874 |
| Compound Name: | 4-butoxy-N-[6-iodo-2-(4-methoxy-3-{[(pyridin-2-yl)sulfanyl]methyl}phenyl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzamide |
| Molecular Weight: | 694.59 |
| Molecular Formula: | C32 H31 I N4 O4 S |
| Smiles: | CCCCOc1ccc(cc1)C(NN1C(c2ccc(c(CSc3ccccn3)c2)OC)Nc2ccc(cc2C1=O)I)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5035 |
| logD: | 6.6591 |
| logSw: | -5.6506 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.93 |
| InChI Key: | PMEGPKBVXFZYFA-SSEXGKCCSA-N |