4-({1-[2-(2-nitroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({1-[2-(2-nitroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide
4-({1-[2-(2-nitroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C260-2388 |
| Compound Name: | 4-({1-[2-(2-nitroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 583.64 |
| Molecular Formula: | C32 H33 N5 O6 |
| Smiles: | C1CC(CCC1CN1C(c2ccccc2N(CC(Nc2ccccc2[N+]([O-])=O)=O)C1=O)=O)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3932 |
| logD: | 4.3822 |
| logSw: | -4.5695 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.246 |
| InChI Key: | XDTKOHMLVZABHG-UHFFFAOYSA-N |