F1739-0048
TL;DR: F1739-0048 (CAS 877809-42-2) is a chemical compound with molecular formula C15H14N4O3S and molecular weight 330.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydroxyphenyl)-2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]ethanone
Also Known As: F1739-0048, 1-(3,4-dihydroxyphenyl)-2-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio)ethanone, 1-(3,4-dihydroxyphenyl)-2-({5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)ethan-1-one, 1-(3,4-dihydroxyphenyl)-2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]ethanone, 1-(3,4-dihydroxyphenyl)-2-(4,6-dimethyl-1,3,3a,7-tetraaza-2-indenylthio)-1-ethanone
| Molecular Formula | C15H14N4O3S |
|---|---|
| Molecular Weight | 330.08 g/mol |
| LogP | 2.12734 |
| Topological Polar Surface Area | 100.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.07867 |
| Heavy Atoms | 23 |
| Complexity | 907.1185 |
Chemical Identifiers
| CAS Number | 877809-42-2 |
|---|---|
| SMILES | CC1=CC(=NC2=NC(=NN12)SCC(=O)C3=CC(=C(C=C3)O)O)C |
Product Overview
F1739-0048 (CAS 877809-42-2), with molecular formula C15H14N4O3S and molecular weight 330.08 g/mol. IUPAC: 1-(3,4-dihydroxyphenyl)-2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]ethanone.
Chemical Property Profile of F1739-0048
Property Insights of F1739-0048
The XLogP value of 2.12734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1739-0048. The TPSA of 100.61 Ų falls within the moderate polarity range, balancing permeability and solubility for F1739-0048. Following Lipinski's Rule of Five, F1739-0048 has 2 hydrogen bond donor(s) and 7 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 F1739-0048?
The CAS number of F1739-0048 is 877809-42-2.
What is the molecular formula of F1739-0048?
The molecular formula of F1739-0048 is C15H14N4O3S.
What is the molecular weight of F1739-0048?
The molecular weight of F1739-0048 is 330.08 g/mol.
Where can I buy F1739-0048?
You can request a quote for F1739-0048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1739-0048?
Yes, KEHONG BIO provides custom synthesis services for F1739-0048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.