ABT 080
TL;DR: ABT 080 (CAS 189498-57-5) is a chemical compound with molecular formula C37H32N2O4 and molecular weight 568.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-bis[4-(quinolin-2-ylmethoxy)phenyl]pentanoic acid
Also Known As: ABT 080, 4,4-bis(4-(2-quinolylmethoxy)phenyl)pentanoic acid, J1.403.131F, 4,4-bis[4-(quinolin-2-ylmethoxy)phenyl]pentanoic Acid, 4,4-Bis[4-(2-quinolylmethoxy)phenyl]pentanoic acid
| Molecular Formula | C37H32N2O4 |
|---|---|
| Molecular Weight | 568.24 g/mol |
| LogP | 8.1118 |
| Topological Polar Surface Area | 81.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 568.2362 |
| Heavy Atoms | 43 |
| Complexity | 1740.3342 |
Chemical Identifiers
| CAS Number | 189498-57-5 |
|---|---|
| SMILES | CC(CCC(=O)O)(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5 |
Product Overview
ABT 080 (CAS 189498-57-5), with molecular formula C37H32N2O4 and molecular weight 568.24 g/mol. IUPAC: 4,4-bis[4-(quinolin-2-ylmethoxy)phenyl]pentanoic acid.
Chemical Property Profile of ABT 080
Property Insights of ABT 080
The XLogP value of 8.1118 indicates that ABT 080 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.54 Ų falls within the moderate polarity range, balancing permeability and solubility for ABT 080. Following Lipinski's Rule of Five, ABT 080 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ABT 080?
The CAS number of ABT 080 is 189498-57-5.
What is the molecular formula of ABT 080?
The molecular formula of ABT 080 is C37H32N2O4.
What is the molecular weight of ABT 080?
The molecular weight of ABT 080 is 568.24 g/mol.
Where can I buy ABT 080?
You can request a quote for ABT 080 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ABT 080?
Yes, KEHONG BIO provides custom synthesis services for ABT 080 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.