N-[2-(4-chlorophenyl)quinoline-4-carbonyl]-beta-alanine
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)quinoline-4-carbonyl]-beta-alanine
N-[2-(4-chlorophenyl)quinoline-4-carbonyl]-beta-alanine
Compound characteristics
| Compound ID: | Y043-2265 |
| Compound Name: | N-[2-(4-chlorophenyl)quinoline-4-carbonyl]-beta-alanine |
| Molecular Weight: | 354.79 |
| Molecular Formula: | C19 H15 Cl N2 O3 |
| Smiles: | C(CNC(c1cc(c2ccc(cc2)[Cl])nc2ccccc12)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5749 |
| logD: | 0.8792 |
| logSw: | -4.2327 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.208 |
| InChI Key: | IYNNPHDFTONLDI-UHFFFAOYSA-N |