ChemDiv1_010748
TL;DR: ChemDiv1_010748 (CAS 328282-10-6) is a chemical compound with molecular formula C16H12Cl2N2OS and molecular weight 350.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-2-[(3,4-dichlorophenyl)methylsulfanyl]-6-methylpyridine-3-carbonitrile
Also Known As: ChemDiv1_010748, Bionet1_002041, 10K-402S, 5-acetyl-2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-methylpyridine-3-carbonitrile, 5-acetyl-2-[(3,4-dichlorobenzyl)sulfanyl]-6-methylnicotinonitrile
| Molecular Formula | C16H12Cl2N2OS |
|---|---|
| Molecular Weight | 350.00 g/mol |
| LogP | 5.0634 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.00473 |
| Heavy Atoms | 22 |
| Complexity | 784.44574 |
Chemical Identifiers
| CAS Number | 328282-10-6 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)SCC2=CC(=C(C=C2)Cl)Cl)C#N)C(=O)C |
Product Overview
ChemDiv1_010748 (CAS 328282-10-6), with molecular formula C16H12Cl2N2OS and molecular weight 350.00 g/mol. IUPAC: 5-acetyl-2-[(3,4-dichlorophenyl)methylsulfanyl]-6-methylpyridine-3-carbonitrile.
Chemical Property Profile of ChemDiv1_010748
Property Insights of ChemDiv1_010748
The XLogP value of 5.0634 indicates that ChemDiv1_010748 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, ChemDiv1_010748 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_010748 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_010748?
The CAS number of ChemDiv1_010748 is 328282-10-6.
What is the molecular formula of ChemDiv1_010748?
The molecular formula of ChemDiv1_010748 is C16H12Cl2N2OS.
What is the molecular weight of ChemDiv1_010748?
The molecular weight of ChemDiv1_010748 is 350.00 g/mol.
Where can I buy ChemDiv1_010748?
You can request a quote for ChemDiv1_010748 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010748?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010748 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.