TL;DR: MKM43J1EZW (CAS 165110-82-7) is a chemical compound with molecular formula C27H21ClFNO4S and molecular weight 509.0864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[2-[(7-chloro-6-fluoroquinolin-2-yl)methoxy]-6,11-dihydrobenzo[c][1]benzoxepin-11-yl]sulfanyl]propanoic acid
Also Known As: 3-((2-((7-Chloro-6-fluoro-2-quinolinyl)methoxy)-6,11-dihydrodibenz(b,E)oxepin-11-yl)thio)propanoic acid, (+)-, 11-(2-Carboxyethylthio)-2-(7-chloro-6-fluoroquinolin-2-yl)methoxy-6,11-dihydrodibenz[b,e]oxepine, MKM43J1EZW
| Molecular Formula | C27H21ClFNO4S |
| Molecular Weight | 509.0864 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 94.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 509.0864 Da |
| Heavy Atoms | 35 |
| Complexity | 719.0 |
| SMILES | C1C2=CC=CC=C2C(C3=C(O1)C=CC(=C3)OCC4=NC5=CC(=C(C=C5C=C4)F)Cl)SCCC(=O)O |
| InChIKey | KGBKEIVIDHHUFB-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that MKM43J1EZW is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for MKM43J1EZW. Following Lipinski's Rule of Five, MKM43J1EZW has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of MKM43J1EZW is 165110-82-7.
The molecular formula of MKM43J1EZW is C27H21ClFNO4S.
The molecular weight of MKM43J1EZW is 509.0864 g/mol.
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