3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-
TL;DR: 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- (CAS 143382-88-1) is a chemical compound with molecular formula C22H25F4N3O3 and molecular weight 455.1832 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclopropyl-7-[(3R)-3-[(1S)-1-(ethylamino)ethyl]pyrrolidin-1-yl]-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid
Also Known As: 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-, (S-(R,S))-1-Cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-1,4-dihydro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid, 1-cyclopropyl-7-[(3R)-3-[(1S)-1-(ethylamino)ethyl]pyrrolidin-1-yl]-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid, 1-Cyclopropyl-1,4-dihydro-8-(trifluoromethyl)-6-fluoro-7-[(3R)-3-[(S)-1-(ethylamino)ethyl]pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid, 1-cyclopropyl-7-[(3R)-3-[(1S)-1-(ethylamino)ethyl]pyrrolidin-1-yl]-6-fluoro-4-oxo-8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid
Technical Specifications
| Molecular Formula | C22H25F4N3O3 |
| Molecular Weight | 455.1832 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.1832 Da |
| Heavy Atoms | 32 |
| Complexity | 785.0 |
| SMILES | CCN[C@@H](C)[C@@H]1CCN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)C4CC4)F |
| InChIKey | KRRFNOYEJSQDRL-NWDGAFQWSA-N |
Chemical Property Profile of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-
Property Insights of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-. Following Lipinski's Rule of Five, 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-?
The CAS number of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- is 143382-88-1.
What is the molecular formula of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-?
The molecular formula of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- is C22H25F4N3O3.
What is the molecular weight of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-?
The molecular weight of 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- is 455.1832 g/mol.
Where can I buy 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-?
You can request a quote for 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-?
Yes, CoreyChem provides custom synthesis services for 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-7-(3-(1-(ethylamino)ethyl)-1-pyrrolidinyl)-6-fluoro-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.