ChemDiv1_018174
TL;DR: ChemDiv1_018174 (CAS 6037-97-4) is a chemical compound with molecular formula C19H14N2O4S and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile
Also Known As: ChemDiv1_018174, BAS 01369728, BIM-0041402.P001, 2-{[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile, A2466/0104698
| Molecular Formula | C19H14N2O4S |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 3.9079 |
| Topological Polar Surface Area | 107.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.0674 |
| Heavy Atoms | 26 |
| Complexity | 1007.11884 |
Chemical Identifiers
| CAS Number | 6037-97-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)SCC(=O)C2=CC(=C(C=C2)O)O)C#N)C3=CC=CO3 |
Product Overview
ChemDiv1_018174 (CAS 6037-97-4), with molecular formula C19H14N2O4S and molecular weight 366.07 g/mol. IUPAC: 2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of ChemDiv1_018174
Property Insights of ChemDiv1_018174
The XLogP value of 3.9079 indicates that ChemDiv1_018174 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.35 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_018174. Following Lipinski's Rule of Five, ChemDiv1_018174 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 ChemDiv1_018174?
The CAS number of ChemDiv1_018174 is 6037-97-4.
What is the molecular formula of ChemDiv1_018174?
The molecular formula of ChemDiv1_018174 is C19H14N2O4S.
What is the molecular weight of ChemDiv1_018174?
The molecular weight of ChemDiv1_018174 is 366.07 g/mol.
Where can I buy ChemDiv1_018174?
You can request a quote for ChemDiv1_018174 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_018174?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_018174 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.