N-[2-(3,4-dimethoxyphenyl)ethyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | C260-1337 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-({1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide |
| Molecular Weight: | 594.62 |
| Molecular Formula: | C33 H30 N4 O7 |
| Smiles: | COc1ccc(CCNC(c2ccc(CN3C(c4ccccc4N(Cc4cccc(c4)[N+]([O-])=O)C3=O)=O)cc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.1238 |
| logD: | 4.1238 |
| logSw: | -4.3766 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.164 |
| InChI Key: | UKWAQGWZMWUEPD-UHFFFAOYSA-N |