AB00147549-02
TL;DR: AB00147549-02 (CAS 442556-69-6) is a chemical compound with molecular formula C19H20N2O4S2 and molecular weight 404.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate
Also Known As: AB00147549-02, allyl 5-cyano-6-((2-ethoxy-2-oxoethyl)thio)-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate, F1109-0200, prop-2-en-1-yl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate, prop-2-enyl 5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C19H20N2O4S2 |
|---|---|
| Molecular Weight | 404.09 g/mol |
| LogP | 3.46958 |
| Topological Polar Surface Area | 88.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 404.08646 |
| Heavy Atoms | 27 |
| Complexity | 819.2627 |
Chemical Identifiers
| CAS Number | 442556-69-6 |
|---|---|
| SMILES | CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CC=CS2)C#N |
Product Overview
AB00147549-02 (CAS 442556-69-6), with molecular formula C19H20N2O4S2 and molecular weight 404.09 g/mol. IUPAC: prop-2-enyl 5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of AB00147549-02
Property Insights of AB00147549-02
The XLogP value of 3.46958 indicates that AB00147549-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00147549-02. Following Lipinski's Rule of Five, AB00147549-02 has 1 hydrogen bond donor(s) and 8 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 AB00147549-02?
The CAS number of AB00147549-02 is 442556-69-6.
What is the molecular formula of AB00147549-02?
The molecular formula of AB00147549-02 is C19H20N2O4S2.
What is the molecular weight of AB00147549-02?
The molecular weight of AB00147549-02 is 404.09 g/mol.
Where can I buy AB00147549-02?
You can request a quote for AB00147549-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00147549-02?
Yes, KEHONG BIO provides custom synthesis services for AB00147549-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.