2-chloro-N-[2-methyl-4-(2-methyl-4-oxoquinazolin-3(4H)-yl)phenyl]-5-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[2-methyl-4-(2-methyl-4-oxoquinazolin-3(4H)-yl)phenyl]-5-nitrobenzamide
2-chloro-N-[2-methyl-4-(2-methyl-4-oxoquinazolin-3(4H)-yl)phenyl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | G856-9646 |
| Compound Name: | 2-chloro-N-[2-methyl-4-(2-methyl-4-oxoquinazolin-3(4H)-yl)phenyl]-5-nitrobenzamide |
| Molecular Weight: | 448.86 |
| Molecular Formula: | C23 H17 Cl N4 O4 |
| Smiles: | CC1=Nc2ccccc2C(N1c1ccc(c(C)c1)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7729 |
| logD: | 3.6 |
| logSw: | -4.2151 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.549 |
| InChI Key: | RGIJHIMFACKZPR-UHFFFAOYSA-N |