AN-919/15183009
TL;DR: AN-919/15183009 (CAS 1231937-75-9) is a chemical compound with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoic acid
Also Known As: AN-919/15183009, (E)-4-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoic acid, (2E)-4-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoic acid, (E)-4-((6-(tert-butyl)-3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-4-oxobut-2-enoic acid, 4-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)amino]-4-oxo-2-butenoic acid
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | 3.35008 |
| Topological Polar Surface Area | 90.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 704.6463 |
Chemical Identifiers
| CAS Number | 1231937-75-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)/C=C/C(=O)O |
Product Overview
AN-919/15183009 (CAS 1231937-75-9), with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol. IUPAC: (E)-4-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobut-2-enoic acid.
Chemical Property Profile of AN-919/15183009
Property Insights of AN-919/15183009
The XLogP value of 3.35008 indicates that AN-919/15183009 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-919/15183009. Following Lipinski's Rule of Five, AN-919/15183009 has 2 hydrogen bond donor(s) and 4 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 AN-919/15183009?
The CAS number of AN-919/15183009 is 1231937-75-9.
What is the molecular formula of AN-919/15183009?
The molecular formula of AN-919/15183009 is C17H20N2O3S.
What is the molecular weight of AN-919/15183009?
The molecular weight of AN-919/15183009 is 332.12 g/mol.
Where can I buy AN-919/15183009?
You can request a quote for AN-919/15183009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-919/15183009?
Yes, KEHONG BIO provides custom synthesis services for AN-919/15183009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.