N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3267 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 531.67 |
| Molecular Formula: | C30 H33 N3 O4 S |
| Smiles: | Cc1ccccc1CSC1=Nc2ccccc2C(N1CCCC(NCCc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.749 |
| logD: | 3.749 |
| logSw: | -3.8622 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.323 |
| InChI Key: | XAJLRVPLEMIRCO-UHFFFAOYSA-N |