N-benzyl-4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-benzyl-4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
N-benzyl-4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3762 |
| Compound Name: | N-benzyl-4-[2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 546.65 |
| Molecular Formula: | C29 H30 N4 O5 S |
| Smiles: | COc1ccc(c(c1)OC)NC(CSC1=Nc2ccccc2C(N1CCCC(NCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8002 |
| logD: | 2.8001 |
| logSw: | -3.6836 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.847 |
| InChI Key: | GLODNQOMPTXAJL-UHFFFAOYSA-N |