2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile
TL;DR: 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile (CAS 338412-33-2) is a chemical compound with molecular formula C12H9N3O2 and molecular weight 227.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-formylpyrrol-1-yl)-4-methoxypyridine-3-carbonitrile
Also Known As: 3-Cyano-2-(2-formyl-1H-pyrrol-1-yl)-4-methoxypyridine, 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile, 2-(2-formylpyrrol-1-yl)-4-methoxypyridine-3-carbonitrile, 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxypyridine-3-carbonitrile, 3-Cyano-2-(2-formyl-1-pyrrolyl)-4-methoxypyridine
| Molecular Formula | C12H9N3O2 |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 1.56508 |
| Topological Polar Surface Area | 67.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.06947 |
| Heavy Atoms | 17 |
| Complexity | 596.03845 |
Chemical Identifiers
| CAS Number | 338412-33-2 |
|---|---|
| SMILES | COC1=C(C(=NC=C1)N2C=CC=C2C=O)C#N |
Product Overview
2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile (CAS 338412-33-2), with molecular formula C12H9N3O2 and molecular weight 227.07 g/mol. IUPAC: 2-(2-formylpyrrol-1-yl)-4-methoxypyridine-3-carbonitrile.
Chemical Property Profile of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile
Property Insights of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile
The XLogP value of 1.56508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile. The TPSA of 67.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile. Following Lipinski's Rule of Five, 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile has 0 hydrogen bond donor(s) and 4 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-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile?
The CAS number of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile is 338412-33-2.
What is the molecular formula of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile?
The molecular formula of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile is C12H9N3O2.
What is the molecular weight of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile?
The molecular weight of 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile is 227.07 g/mol.
Where can I buy 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile?
You can request a quote for 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-formyl-1H-pyrrol-1-yl)-4-methoxynicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.