4-({1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-({1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
4-({1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | C260-1347 |
| Compound Name: | 4-({1-[(2-chloro-4-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 602.06 |
| Molecular Formula: | C33 H29 Cl F N3 O5 |
| Smiles: | COc1ccc(CCNC(c2ccc(CN3C(c4ccccc4N(Cc4ccc(cc4[Cl])F)C3=O)=O)cc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.9865 |
| logD: | 4.9865 |
| logSw: | -5.0353 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.783 |
| InChI Key: | IRYFEXXVRNAKOM-UHFFFAOYSA-N |