A4006/0170789
TL;DR: A4006/0170789 (CAS 899370-08-2) is a chemical compound with molecular formula C16H11F3N4O3S and molecular weight 396.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-amino-6-pyridin-3-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carbonyl]amino]acetic acid
Also Known As: A4006/0170789, N-{[3-amino-6-(pyridin-3-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]carbonyl}glycine, 2-[[3-amino-6-pyridin-3-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carbonyl]amino]acetic acid, (3-Amino-6-(pyridin-3-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carbonyl)glycine, 2-{[3-amino-6-(pyridin-3-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]formamido}acetic acid
| Molecular Formula | C16H11F3N4O3S |
|---|---|
| Molecular Weight | 396.05 g/mol |
| LogP | 2.7737 |
| Topological Polar Surface Area | 118.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.05038 |
| Heavy Atoms | 27 |
| Complexity | 1034.8068 |
Chemical Identifiers
| CAS Number | 899370-08-2 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=C(S3)C(=O)NCC(=O)O)N |
Product Overview
A4006/0170789 (CAS 899370-08-2), with molecular formula C16H11F3N4O3S and molecular weight 396.05 g/mol. IUPAC: 2-[[3-amino-6-pyridin-3-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carbonyl]amino]acetic acid.
Chemical Property Profile of A4006/0170789
Property Insights of A4006/0170789
The XLogP value of 2.7737 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A4006/0170789. The TPSA of 118.2 Ų falls within the moderate polarity range, balancing permeability and solubility for A4006/0170789. Following Lipinski's Rule of Five, A4006/0170789 has 3 hydrogen bond donor(s) and 6 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 A4006/0170789?
The CAS number of A4006/0170789 is 899370-08-2.
What is the molecular formula of A4006/0170789?
The molecular formula of A4006/0170789 is C16H11F3N4O3S.
What is the molecular weight of A4006/0170789?
The molecular weight of A4006/0170789 is 396.05 g/mol.
Where can I buy A4006/0170789?
You can request a quote for A4006/0170789 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4006/0170789?
Yes, KEHONG BIO provides custom synthesis services for A4006/0170789 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.