N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-(3,4-dimethoxyphenyl)quinazolin-4-amine
Chemical Structure Depiction of
N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-(3,4-dimethoxyphenyl)quinazolin-4-amine
N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-(3,4-dimethoxyphenyl)quinazolin-4-amine
Compound characteristics
| Compound ID: | 3764-6599 |
| Compound Name: | N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-2-(3,4-dimethoxyphenyl)quinazolin-4-amine |
| Molecular Weight: | 542.98 |
| Molecular Formula: | C29 H23 Cl N4 O5 |
| Smiles: | Cc1cc(ccc1[Cl])Oc1cc(cc(c1)[N+]([O-])=O)Nc1c2ccccc2nc(c2ccc(c(c2)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 8.7012 |
| logD: | 8.0956 |
| logSw: | -6.8087 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.195 |
| InChI Key: | AICYVLWAVKMFCS-UHFFFAOYSA-N |