3-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
3-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | K284-3727 |
| Compound Name: | 3-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 471.62 |
| Molecular Formula: | C28 H29 N3 O2 S |
| Smiles: | Cc1ccc(CSC2=Nc3ccccc3C(N2CCC(NCCc2ccccc2)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7737 |
| logD: | 4.7737 |
| logSw: | -4.4311 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.062 |
| InChI Key: | UNIVILNESXJTQC-UHFFFAOYSA-N |