![6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile structure](/static/products/4452/445260-24-2.webp)
6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile
TL;DR: 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile (CAS 445260-24-2) is a chemical compound with molecular formula C22H16F2N2O2S and molecular weight 410.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(difluoromethyl)-2-[(5-formyl-2-methoxyphenyl)methylsulfanyl]-4-phenylpyridine-3-carbonitrile
Also Known As: 6-(DIFLUOROMETHYL)-2-[(5-FORMYL-2-METHOXYBENZYL)THIO]-4-PHENYLNICOTINONITRILE, 6-(DIFLUOROMETHYL)-2-{[(5-FORMYL-2-METHOXYPHENYL)METHYL]SULFANYL}-4-PHENYLPYRIDINE-3-CARBONITRILE, 6-(difluoromethyl)-2-((5-formyl-2-methoxybenzyl)thio)-4-phenylnicotinonitrile, 6-(difluoromethyl)-2-[(5-formyl-2-methoxyphenyl)methylsulfanyl]-4-phenylpyridine-3-carbonitrile, 6-(difluoromethyl)-2-[(5-formyl-2-methoxy-phenyl)methylsulfanyl]-4-phenyl-pyridine-3-carbonitrile
| Molecular Formula | C22H16F2N2O2S |
|---|---|
| Molecular Weight | 410.09 g/mol |
| LogP | 5.67128 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.09006 |
| Heavy Atoms | 29 |
| Complexity | 1066.3977 |
Chemical Identifiers
| CAS Number | 445260-24-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=O)CSC2=C(C(=CC(=N2)C(F)F)C3=CC=CC=C3)C#N |
Product Overview
6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile (CAS 445260-24-2), with molecular formula C22H16F2N2O2S and molecular weight 410.09 g/mol. IUPAC: 6-(difluoromethyl)-2-[(5-formyl-2-methoxyphenyl)methylsulfanyl]-4-phenylpyridine-3-carbonitrile.
Chemical Property Profile of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile
Property Insights of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile
The XLogP value of 5.67128 indicates that 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile. Following Lipinski's Rule of Five, 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile?
The CAS number of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile is 445260-24-2.
What is the molecular formula of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile?
The molecular formula of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile is C22H16F2N2O2S.
What is the molecular weight of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile?
The molecular weight of 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile is 410.09 g/mol.
Where can I buy 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile?
You can request a quote for 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(Difluoromethyl)-2-[(5-formyl-2-methoxybenzyl)thio]-4-phenylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.