TL;DR: 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl- (CAS 113737-83-0) is a chemical compound with molecular formula C15H10ClNO3 and molecular weight 287.0349 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione
Also Known As: 7-chloro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione, 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl-, 2,4(1H,3H)-Quinolinedione,7-chloro-3-hydroxy-3-phenyl, 7-Chloro-3-hydroxy-3-phenylquinoline-2,4(1H,3H)-dione
| Molecular Formula | C15H10ClNO3 |
| Molecular Weight | 287.0349 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 287.0349 Da |
| Heavy Atoms | 20 |
| Complexity | 421.0 |
| SMILES | C1=CC=C(C=C1)C2(C(=O)C3=C(C=C(C=C3)Cl)NC2=O)O |
| InChIKey | LBMOEKLVOHHWLQ-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl-. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl-. Following Lipinski's Rule of Five, 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl- is 113737-83-0.
The molecular formula of 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl- is C15H10ClNO3.
The molecular weight of 2,4(1H,3H)-Quinolinedione, 7-chloro-3-hydroxy-3-phenyl- is 287.0349 g/mol.
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