6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile
TL;DR: 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile (CAS 119672-31-0) is a chemical compound with molecular formula C13H11N3O3S and molecular weight 289.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-(benzenesulfonyl)-2-methoxypyridine-3-carbonitrile
Also Known As: 6-amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile, 6-amino-5-(benzenesulfonyl)-2-methoxypyridine-3-carbonitrile, AA-516/12432360, 3-Pyridinecarbonitrile, 6-amino-2-methoxy-5-(phenylsulfonyl)-, 6-amino-5-(benzenesulfonyl)-2-methoxy-3-pyridinecarbonitrile
| Molecular Formula | C13H11N3O3S |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 1.37688 |
| Topological Polar Surface Area | 106.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.05212 |
| Heavy Atoms | 20 |
| Complexity | 780.49896 |
Chemical Identifiers
| CAS Number | 119672-31-0 |
|---|---|
| SMILES | COC1=NC(=C(C=C1C#N)S(=O)(=O)C2=CC=CC=C2)N |
Product Overview
6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile (CAS 119672-31-0), with molecular formula C13H11N3O3S and molecular weight 289.05 g/mol. IUPAC: 6-amino-5-(benzenesulfonyl)-2-methoxypyridine-3-carbonitrile.
Chemical Property Profile of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile
Property Insights of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile
The XLogP value of 1.37688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile. The TPSA of 106.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile. Following Lipinski's Rule of Five, 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile has 1 hydrogen bond donor(s) and 6 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 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile?
The CAS number of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile is 119672-31-0.
What is the molecular formula of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile?
The molecular formula of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile is C13H11N3O3S.
What is the molecular weight of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile?
The molecular weight of 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile is 289.05 g/mol.
Where can I buy 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile?
You can request a quote for 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-2-methoxy-5-(phenylsulfonyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.