PD 139735
TL;DR: PD 139735 (CAS 143383-67-9) is a chemical compound with molecular formula C21H23F4N3O3 and molecular weight 441.16754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclopropyl-6-fluoro-7-[(3R)-3-[(1S)-1-(methylamino)ethyl]pyrrolidin-1-yl]-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid
Also Known As: PD 139735, (S-(R,S))-1-Cyclopropyl-6-fluoro-1,4-dihydro-7-(3-(1-(methylamino)ethyl)-1-pyrrolidinyl)-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid, 3-Quinolinecarboxylic acid, 1,4-dihydro-1-cyclopropyl-6-fluoro-7-(3-(1-(methylamino)ethyl)-1-pyrrolidinyl)-4-oxo-8-(trifluoromethyl)-, (S-(R*,S*))-, 1-cyclopropyl-6-fluoro-7-[(3R)-3-[(1S)-1-(methylamino)ethyl]pyrrolidin-1-yl]-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid, 1-cyclopropyl-6-fluoro-7-{(3R)-3-[(1S)-1-(methylamino)ethyl]pyrrolidin-1-yl}-4-oxo-8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H23F4N3O3 |
| Molecular Weight | 441.16754 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.16754 Da |
| Heavy Atoms | 31 |
| Complexity | 769.0 |
| SMILES | C[C@@H]([C@@H]1CCN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)C4CC4)F)NC |
| InChIKey | LNTNNMBWJUVBRJ-WDEREUQCSA-N |
Chemical Property Profile of PD 139735
Property Insights of PD 139735
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PD 139735. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for PD 139735. Following Lipinski's Rule of Five, PD 139735 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 PD 139735?
The CAS number of PD 139735 is 143383-67-9.
What is the molecular formula of PD 139735?
The molecular formula of PD 139735 is C21H23F4N3O3.
What is the molecular weight of PD 139735?
The molecular weight of PD 139735 is 441.16754 g/mol.
Where can I buy PD 139735?
You can request a quote for PD 139735 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PD 139735?
Yes, CoreyChem provides custom synthesis services for PD 139735 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.