A2107/0088561
TL;DR: A2107/0088561 (CAS 88488-43-1) is a chemical compound with molecular formula C16H18F2N4O3 and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-ethyl-6,8-difluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
Also Known As: A2107/0088561, 5-amino-1-ethyl-6,8-difluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid, 5-amino-1-ethyl-6,8-difluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid, 5-amino-1-ethyl-6,8-difluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid, 5-amino-1-ethyl-6,8-difluoro-4-oxo-7-piperazinylhydroquinoline-3-carboxylic ac id
| Molecular Formula | C16H18F2N4O3 |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 0.9896 |
| Topological Polar Surface Area | 100.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.1347 |
| Heavy Atoms | 25 |
| Complexity | 920.2065 |
Chemical Identifiers
| CAS Number | 88488-43-1 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=C(C(=C(C(=C21)F)N3CCNCC3)F)N)C(=O)O |
Product Overview
A2107/0088561 (CAS 88488-43-1), with molecular formula C16H18F2N4O3 and molecular weight 352.13 g/mol. IUPAC: 5-amino-1-ethyl-6,8-difluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid.
Chemical Property Profile of A2107/0088561
Property Insights of A2107/0088561
The XLogP value of 0.9896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2107/0088561. The TPSA of 100.59 Ų falls within the moderate polarity range, balancing permeability and solubility for A2107/0088561. Following Lipinski's Rule of Five, A2107/0088561 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2107/0088561?
The CAS number of A2107/0088561 is 88488-43-1.
What is the molecular formula of A2107/0088561?
The molecular formula of A2107/0088561 is C16H18F2N4O3.
What is the molecular weight of A2107/0088561?
The molecular weight of A2107/0088561 is 352.13 g/mol.
Where can I buy A2107/0088561?
You can request a quote for A2107/0088561 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2107/0088561?
Yes, KEHONG BIO provides custom synthesis services for A2107/0088561 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.