2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile
TL;DR: 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile (CAS 304650-25-7) is a chemical compound with molecular formula C16H20Cl3N3O4 and molecular weight 423.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile
Also Known As: 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile, 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadecan-13-yl)pyridine-3-carbonitrile, 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadecan-13-yl)nicotinonitrile
| Molecular Formula | C16H20Cl3N3O4 |
|---|---|
| Molecular Weight | 423.05 g/mol |
| LogP | 2.79988 |
| Topological Polar Surface Area | 76.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 423.05194 |
| Heavy Atoms | 26 |
| Complexity | 611.73804 |
Chemical Identifiers
| CAS Number | 304650-25-7 |
|---|---|
| SMILES | C1COCCOCCOCCOCCN1C2=C(C(=C(C(=N2)Cl)C#N)Cl)Cl |
Product Overview
2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile (CAS 304650-25-7), with molecular formula C16H20Cl3N3O4 and molecular weight 423.05 g/mol. IUPAC: 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile.
Chemical Property Profile of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile
Property Insights of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile
The XLogP value of 2.79988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile. The TPSA of 76.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile. Following Lipinski's Rule of Five, 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile has 0 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 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile?
The CAS number of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile is 304650-25-7.
What is the molecular formula of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile?
The molecular formula of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile is C16H20Cl3N3O4.
What is the molecular weight of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile?
The molecular weight of 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile is 423.05 g/mol.
Where can I buy 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile?
You can request a quote for 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,4,5-trichloro-6-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)pyridine-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.