A-70826
TL;DR: A-70826 (CAS 129670-72-0) is a chemical compound with molecular formula C29H33F3N6O5 and molecular weight 602.24646 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[3-[[(2S)-2-[[(2S)-2-aminopentanoyl]amino]pentanoyl]amino]pyrrolidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
Also Known As: A-70826, 7-[3-[[(2S)-2-[[(2S)-2-aminopentanoyl]amino]pentanoyl]amino]pyrrolidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
Technical Specifications
| Molecular Formula | C29H33F3N6O5 |
| Molecular Weight | 602.24646 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 158.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 602.24646 Da |
| Heavy Atoms | 43 |
| Complexity | 1080.0 |
| SMILES | CCC[C@@H](C(=O)N[C@@H](CCC)C(=O)NC1CCN(C1)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=C(C=C(C=C4)F)F)C(=O)O)F)N |
| InChIKey | QFQGBFRGILVSNY-LALCZMHNSA-N |
Chemical Property Profile of A-70826
Property Insights of A-70826
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A-70826. The TPSA of 158.0 Ų indicates high polarity, suggesting A-70826 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A-70826 has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of A-70826?
The CAS number of A-70826 is 129670-72-0.
What is the molecular formula of A-70826?
The molecular formula of A-70826 is C29H33F3N6O5.
What is the molecular weight of A-70826?
The molecular weight of A-70826 is 602.24646 g/mol.
Where can I buy A-70826?
You can request a quote for A-70826 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for A-70826?
Yes, CoreyChem provides custom synthesis services for A-70826 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.