AN-584/43493881
TL;DR: AN-584/43493881 (CAS 848278-49-9) is a chemical compound with molecular formula C24H21N5O3S3 and molecular weight 523.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AN-584/43493881, ethyl 2-[({[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridinyl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-2-yl)sulfanylacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[({[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C24H21N5O3S3 |
|---|---|
| Molecular Weight | 523.08 g/mol |
| LogP | 4.98346 |
| Topological Polar Surface Area | 141.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 523.0806 |
| Heavy Atoms | 35 |
| Complexity | 1366.6625 |
Chemical Identifiers
| CAS Number | 848278-49-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=C(C(=C(C(=N3)N)C#N)C4=CC=CS4)C#N |
Product Overview
AN-584/43493881 (CAS 848278-49-9), with molecular formula C24H21N5O3S3 and molecular weight 523.08 g/mol. IUPAC: ethyl 2-[[2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)sulfanyl]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AN-584/43493881
Property Insights of AN-584/43493881
The XLogP value of 4.98346 indicates that AN-584/43493881 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.89 Ų indicates high polarity, suggesting AN-584/43493881 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AN-584/43493881 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-584/43493881?
The CAS number of AN-584/43493881 is 848278-49-9.
What is the molecular formula of AN-584/43493881?
The molecular formula of AN-584/43493881 is C24H21N5O3S3.
What is the molecular weight of AN-584/43493881?
The molecular weight of AN-584/43493881 is 523.08 g/mol.
Where can I buy AN-584/43493881?
You can request a quote for AN-584/43493881 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-584/43493881?
Yes, KEHONG BIO provides custom synthesis services for AN-584/43493881 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.