2-[2,4-dioxo-3-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}phenyl)-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[2,4-dioxo-3-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}phenyl)-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[2,4-dioxo-3-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}phenyl)-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F144-0066 |
| Compound Name: | 2-[2,4-dioxo-3-(4-{2-oxo-2-[(propan-2-yl)amino]ethyl}phenyl)-3,4-dihydroquinazolin-1(2H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C28 H28 N4 O4 S |
| Smiles: | CC(C)NC(Cc1ccc(cc1)N1C(c2ccccc2N(CC(Nc2cccc(c2)SC)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9004 |
| logD: | 2.9004 |
| logSw: | -3.6678 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.25 |
| InChI Key: | YZJBBRWFFBVJDQ-UHFFFAOYSA-N |