AO-476/43417121
TL;DR: AO-476/43417121 (CAS 423142-90-9) is a chemical compound with molecular formula C19H21N5O2S and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate
Also Known As: AO-476/43417121, ethyl 5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate, ethyl 5-methyl-4-(4-(pyridin-2-yl)piperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate
| Molecular Formula | C19H21N5O2S |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 2.89802 |
| Topological Polar Surface Area | 71.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.1416 |
| Heavy Atoms | 27 |
| Complexity | 951.3934 |
Chemical Identifiers
| CAS Number | 423142-90-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N=CN=C2S1)N3CCN(CC3)C4=CC=CC=N4)C |
Product Overview
AO-476/43417121 (CAS 423142-90-9), with molecular formula C19H21N5O2S and molecular weight 383.14 g/mol. IUPAC: ethyl 5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of AO-476/43417121
Property Insights of AO-476/43417121
The XLogP value of 2.89802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-476/43417121. The TPSA of 71.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-476/43417121. Following Lipinski's Rule of Five, AO-476/43417121 has 0 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 AO-476/43417121?
The CAS number of AO-476/43417121 is 423142-90-9.
What is the molecular formula of AO-476/43417121?
The molecular formula of AO-476/43417121 is C19H21N5O2S.
What is the molecular weight of AO-476/43417121?
The molecular weight of AO-476/43417121 is 383.14 g/mol.
Where can I buy AO-476/43417121?
You can request a quote for AO-476/43417121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-476/43417121?
Yes, KEHONG BIO provides custom synthesis services for AO-476/43417121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.