5-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(2-phenylethyl)pentanamide
Chemical Structure Depiction of
5-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(2-phenylethyl)pentanamide
5-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(2-phenylethyl)pentanamide
Compound characteristics
| Compound ID: | C260-2152 |
| Compound Name: | 5-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(2-phenylethyl)pentanamide |
| Molecular Weight: | 500.55 |
| Molecular Formula: | C28 H28 N4 O5 |
| Smiles: | C(CCN1C(c2ccccc2N(Cc2cccc(c2)[N+]([O-])=O)C1=O)=O)CC(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4096 |
| logD: | 3.4096 |
| logSw: | -3.956 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.94 |
| InChI Key: | SSPXHFLNSAXTEX-UHFFFAOYSA-N |