N-(2-{[7-chloro-2-(2-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(2-{[7-chloro-2-(2-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-nitrobenzamide
N-(2-{[7-chloro-2-(2-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | V027-7598 |
| Compound Name: | N-(2-{[7-chloro-2-(2-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-nitrobenzamide |
| Molecular Weight: | 482.32 |
| Molecular Formula: | C23 H17 Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | C(CNc1c2ccc(cc2nc(c2ccccc2[Cl])n1)[Cl])NC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3521 |
| logD: | 5.086 |
| logSw: | -5.7714 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.877 |
| InChI Key: | YJZVSPRSSBYBGJ-UHFFFAOYSA-N |