A3777/0160287
TL;DR: A3777/0160287 (CAS 727679-24-5) is a chemical compound with molecular formula C21H11Cl2N3O2S and molecular weight 438.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-1-benzothiophene-2-carboxamide
Also Known As: A3777/0160287, 3-chloro-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-1-benzothiophene-2-carboxamide, 3-chloro-N-(2-chloro-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)benzo[b]thiophene-2-carboxamide
| Molecular Formula | C21H11Cl2N3O2S |
|---|---|
| Molecular Weight | 438.99 g/mol |
| LogP | 6.6636 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 438.9949 |
| Heavy Atoms | 29 |
| Complexity | 1360.5033 |
Chemical Identifiers
| CAS Number | 727679-24-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=C(C=CC(=C3)C4=NC5=C(O4)C=CC=N5)Cl)Cl |
Product Overview
A3777/0160287 (CAS 727679-24-5), with molecular formula C21H11Cl2N3O2S and molecular weight 438.99 g/mol. IUPAC: 3-chloro-N-[2-chloro-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of A3777/0160287
Property Insights of A3777/0160287
The XLogP value of 6.6636 indicates that A3777/0160287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for A3777/0160287. Following Lipinski's Rule of Five, A3777/0160287 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 A3777/0160287?
The CAS number of A3777/0160287 is 727679-24-5.
What is the molecular formula of A3777/0160287?
The molecular formula of A3777/0160287 is C21H11Cl2N3O2S.
What is the molecular weight of A3777/0160287?
The molecular weight of A3777/0160287 is 438.99 g/mol.
Where can I buy A3777/0160287?
You can request a quote for A3777/0160287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3777/0160287?
Yes, KEHONG BIO provides custom synthesis services for A3777/0160287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.