A3913/0166429
TL;DR: A3913/0166429 (CAS 847478-44-8) is a chemical compound with molecular formula C21H13F4N3O3 and molecular weight 431.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetrafluoro-4-methoxy-N-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Also Known As: A3913/0166429, 2,3,5,6-tetrafluoro-4-methoxy-N-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide, 2,3,5,6-tetrafluoro-4-methoxy-N-(2-methyl-4-(oxazolo[4,5-b]pyridin-2-yl)phenyl)benzamide, 2,3,5,6-TETRAFLUORO-4-METHOXY-N-(2-METHYL-4-{[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YL}PHENYL)BENZAMIDE
| Molecular Formula | C21H13F4N3O3 |
|---|---|
| Molecular Weight | 431.09 g/mol |
| LogP | 5.01552 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.0893 |
| Heavy Atoms | 31 |
| Complexity | 1275.192 |
Chemical Identifiers
| CAS Number | 847478-44-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C2=NC3=C(O2)C=CC=N3)NC(=O)C4=C(C(=C(C(=C4F)F)OC)F)F |
Product Overview
A3913/0166429 (CAS 847478-44-8), with molecular formula C21H13F4N3O3 and molecular weight 431.09 g/mol. IUPAC: 2,3,5,6-tetrafluoro-4-methoxy-N-[2-methyl-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide.
Chemical Property Profile of A3913/0166429
Property Insights of A3913/0166429
The XLogP value of 5.01552 indicates that A3913/0166429 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for A3913/0166429. Following Lipinski's Rule of Five, A3913/0166429 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 A3913/0166429?
The CAS number of A3913/0166429 is 847478-44-8.
What is the molecular formula of A3913/0166429?
The molecular formula of A3913/0166429 is C21H13F4N3O3.
What is the molecular weight of A3913/0166429?
The molecular weight of A3913/0166429 is 431.09 g/mol.
Where can I buy A3913/0166429?
You can request a quote for A3913/0166429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3913/0166429?
Yes, KEHONG BIO provides custom synthesis services for A3913/0166429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.