RefChem:448678
TL;DR: RefChem:448678 (CAS 578700-95-5) is a chemical compound with molecular formula C17H15N3O4S and molecular weight 357.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dihydroxyphenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: Salor-int l414298-1ea, 2-{[4-allyl-5-(2-furyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone, 2-((4-Allyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)-1-(3,4-dihydroxyphenyl)ethanone, 1-(3,4-dihydroxyphenyl)-2-(5-(2-furyl)-4-prop-2-enyl(1,2,4-triazol-3-ylthio))e than-1-one, 1-(3,4-dihydroxyphenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
| Molecular Formula | C17H15N3O4S |
|---|---|
| Molecular Weight | 357.08 g/mol |
| LogP | 3.1103 |
| Topological Polar Surface Area | 101.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 357.07834 |
| Heavy Atoms | 25 |
| Complexity | 902.7662 |
Chemical Identifiers
| CAS Number | 578700-95-5 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)O)O)C3=CC=CO3 |
Product Overview
RefChem:448678 (CAS 578700-95-5), with molecular formula C17H15N3O4S and molecular weight 357.08 g/mol. IUPAC: 1-(3,4-dihydroxyphenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of RefChem:448678
Property Insights of RefChem:448678
The XLogP value of 3.1103 indicates that RefChem:448678 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.38 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:448678. Following Lipinski's Rule of Five, RefChem:448678 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 RefChem:448678?
The CAS number of RefChem:448678 is 578700-95-5.
What is the molecular formula of RefChem:448678?
The molecular formula of RefChem:448678 is C17H15N3O4S.
What is the molecular weight of RefChem:448678?
The molecular weight of RefChem:448678 is 357.08 g/mol.
Where can I buy RefChem:448678?
You can request a quote for RefChem:448678 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:448678?
Yes, KEHONG BIO provides custom synthesis services for RefChem:448678 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.