AS-871/42850422
TL;DR: AS-871/42850422 (CAS 690641-97-5) is a chemical compound with molecular formula C20H24N2O4S2 and molecular weight 420.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,1-dioxothiolan-3-yl)-5,6-dimethyl-2,4-dihydrothieno[2,3-d]pyrimidin-1-yl]-(4-methoxyphenyl)methanone
Also Known As: AS-871/42850422, [3-(1,1-dioxidotetrahydrothiophen-3-yl)-5,6-dimethyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl](4-methoxyphenyl)methanone, [3-(1,1-dioxothiolan-3-yl)-5,6-dimethyl-2,4-dihydrothieno[2,3-d]pyrimidin-1-yl]-(4-methoxyphenyl)methanone, 3-{1-[(4-methoxyphenyl)carbonyl]-5,6-dimethyl-1,2,3,4-tetrahydrothiopheno[2,3- d]pyrimidin-3-yl}thiolane-1,1-dione, 4-[(3-(1,1-dioxidotetrahydro-3-thienyl)-5,6-dimethyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)carbonyl]phenyl methyl ether
| Molecular Formula | C20H24N2O4S2 |
|---|---|
| Molecular Weight | 420.12 g/mol |
| LogP | 2.98054 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.11774 |
| Heavy Atoms | 28 |
| Complexity | 1011.57184 |
Chemical Identifiers
| CAS Number | 690641-97-5 |
|---|---|
| SMILES | CC1=C(SC2=C1CN(CN2C(=O)C3=CC=C(C=C3)OC)C4CCS(=O)(=O)C4)C |
Product Overview
AS-871/42850422 (CAS 690641-97-5), with molecular formula C20H24N2O4S2 and molecular weight 420.12 g/mol. IUPAC: [3-(1,1-dioxothiolan-3-yl)-5,6-dimethyl-2,4-dihydrothieno[2,3-d]pyrimidin-1-yl]-(4-methoxyphenyl)methanone.
Chemical Property Profile of AS-871/42850422
Property Insights of AS-871/42850422
The XLogP value of 2.98054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/42850422. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42850422. Following Lipinski's Rule of Five, AS-871/42850422 has 0 hydrogen bond donor(s) and 6 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 AS-871/42850422?
The CAS number of AS-871/42850422 is 690641-97-5.
What is the molecular formula of AS-871/42850422?
The molecular formula of AS-871/42850422 is C20H24N2O4S2.
What is the molecular weight of AS-871/42850422?
The molecular weight of AS-871/42850422 is 420.12 g/mol.
Where can I buy AS-871/42850422?
You can request a quote for AS-871/42850422 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42850422?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42850422 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.