2-[2,4-dioxo-3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[2,4-dioxo-3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[2,4-dioxo-3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C260-3087 |
| Compound Name: | 2-[2,4-dioxo-3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 502.59 |
| Molecular Formula: | C27 H26 N4 O4 S |
| Smiles: | CSc1cccc(c1)NC(CN1C(N(CC(NCCc2ccccc2)=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9393 |
| logD: | 2.9393 |
| logSw: | -3.6733 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.729 |
| InChI Key: | VOOHERFLIALUFO-UHFFFAOYSA-N |