2-{[N-(4-chlorobenzoyl)-3-(2-oxo-1,2-dihydroquinolin-4-yl)alanyl]amino}butanoic acid
Chemical Structure Depiction of
2-{[N-(4-chlorobenzoyl)-3-(2-oxo-1,2-dihydroquinolin-4-yl)alanyl]amino}butanoic acid
2-{[N-(4-chlorobenzoyl)-3-(2-oxo-1,2-dihydroquinolin-4-yl)alanyl]amino}butanoic acid
Compound characteristics
| Compound ID: | Y040-8810 |
| Compound Name: | 2-{[N-(4-chlorobenzoyl)-3-(2-oxo-1,2-dihydroquinolin-4-yl)alanyl]amino}butanoic acid |
| Molecular Weight: | 455.9 |
| Molecular Formula: | C23 H22 Cl N3 O5 |
| Smiles: | CCC(C(O)=O)NC(C(CC1=CC(Nc2ccccc12)=O)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9572 |
| logD: | -1.7027 |
| logSw: | -3.1171 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.826 |
| InChI Key: | OTGCNLMXRLINMR-UHFFFAOYSA-N |