3-(4-ethylphenyl)-1-[(3-nitrophenyl)methyl]-2,4-dioxo-N-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-ethylphenyl)-1-[(3-nitrophenyl)methyl]-2,4-dioxo-N-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-(4-ethylphenyl)-1-[(3-nitrophenyl)methyl]-2,4-dioxo-N-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C487-0283 |
| Compound Name: | 3-(4-ethylphenyl)-1-[(3-nitrophenyl)methyl]-2,4-dioxo-N-(2-phenylethyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 548.6 |
| Molecular Formula: | C32 H28 N4 O5 |
| Smiles: | CCc1ccc(cc1)N1C(c2ccc(cc2N(Cc2cccc(c2)[N+]([O-])=O)C1=O)C(NCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1635 |
| logD: | 5.1635 |
| logSw: | -4.9797 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.292 |
| InChI Key: | XDXNYGIPUGJQEC-UHFFFAOYSA-N |