5-[1-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-phenylpentanamide
Chemical Structure Depiction of
5-[1-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-phenylpentanamide
5-[1-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-phenylpentanamide
Compound characteristics
| Compound ID: | F142-0509 |
| Compound Name: | 5-[1-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-phenylpentanamide |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C28 H28 N4 O4 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(N(CCCCC(Nc2ccccc2)=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7476 |
| logD: | 3.7476 |
| logSw: | -3.9695 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.544 |
| InChI Key: | IRWCOBOXNUHANM-UHFFFAOYSA-N |