N-cyclopentyl-4-{[2-{[1-(2-ethylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopentyl-4-{[2-{[1-(2-ethylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopentyl-4-{[2-{[1-(2-ethylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | K284-7245 |
| Compound Name: | N-cyclopentyl-4-{[2-{[1-(2-ethylanilino)-1-oxobutan-2-yl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 568.74 |
| Molecular Formula: | C33 H36 N4 O3 S |
| Smiles: | CCC(C(Nc1ccccc1CC)=O)SC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3488 |
| logD: | 6.3488 |
| logSw: | -5.5023 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.941 |
| InChI Key: | RCMSPMHFGGKXCD-LJAQVGFWSA-N |