N-cyclopentyl-4-{[2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopentyl-4-{[2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopentyl-4-{[2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | K284-7248 |
| Compound Name: | N-cyclopentyl-4-{[2-{[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 570.71 |
| Molecular Formula: | C32 H34 N4 O4 S |
| Smiles: | CCC(C(Nc1cccc(c1)OC)=O)SC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6171 |
| logD: | 5.6171 |
| logSw: | -5.3005 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.182 |
| InChI Key: | NKEKQQYMRCKQGF-NDEPHWFRSA-N |