AS-871/41248015
TL;DR: AS-871/41248015 (CAS 466643-13-0) is a chemical compound with molecular formula C10H10N4OS2 and molecular weight 266.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-4-[(E)-(3-methylthiophen-2-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one
Also Known As: AS-871/41248015, 6-methyl-4-[(E)-(3-methylthiophen-2-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one, 6-methyl-4-{[(3-methyl-2-thienyl)methylene]amino}-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one, 4-[(1E)-2-(3-methyl(2-thienyl))-1-azavinyl]-6-methyl-3-thioxo-2H-1,2,4-triazin -5-one
| Molecular Formula | C10H10N4OS2 |
|---|---|
| Molecular Weight | 266.03 g/mol |
| LogP | 1.86143 |
| Topological Polar Surface Area | 63.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.0296 |
| Heavy Atoms | 17 |
| Complexity | 680.09973 |
Chemical Identifiers
| CAS Number | 466643-13-0 |
|---|---|
| SMILES | CC1=C(SC=C1)/C=N/N2C(=O)C(=NNC2=S)C |
Product Overview
AS-871/41248015 (CAS 466643-13-0), with molecular formula C10H10N4OS2 and molecular weight 266.03 g/mol. IUPAC: 6-methyl-4-[(E)-(3-methylthiophen-2-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one.
Chemical Property Profile of AS-871/41248015
Property Insights of AS-871/41248015
The XLogP value of 1.86143 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AS-871/41248015. The TPSA of 63.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/41248015. Following Lipinski's Rule of Five, AS-871/41248015 has 1 hydrogen bond donor(s) and 5 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-871/41248015?
The CAS number of AS-871/41248015 is 466643-13-0.
What is the molecular formula of AS-871/41248015?
The molecular formula of AS-871/41248015 is C10H10N4OS2.
What is the molecular weight of AS-871/41248015?
The molecular weight of AS-871/41248015 is 266.03 g/mol.
Where can I buy AS-871/41248015?
You can request a quote for AS-871/41248015 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41248015?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41248015 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.