1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile
TL;DR: 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile (CAS 79084-83-6) is a chemical compound with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile
Also Known As: 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile, 1-anilino-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile, 1,2-dihydro-6-hydroxy-4-methyl-2-oxo-1- nicotinonitrile, 2-hydroxy-4-methyl-6-oxo-1-(phenylamino)-1,6-dihydropyridine-3-carbonitrile, 2-hydroxy-4-methyl-6-oxo-1-(phenylamino)pyridine-3-carbonitrile
| Molecular Formula | C13H11N3O2 |
|---|---|
| Molecular Weight | 241.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 76.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.08513 |
| Heavy Atoms | 18 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 79084-83-6 |
|---|---|
| SMILES | CC1=CC(=O)N(C(=C1C#N)O)NC2=CC=CC=C2 |
| InChIKey | LPNMGEFCVOZFQT-UHFFFAOYSA-N |
Product Overview
1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile (CAS 79084-83-6), with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol. IUPAC: 1-anilino-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile.
Chemical Property Profile of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile
Property Insights of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile. Following Lipinski's Rule of Five, 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile has 2 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 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile?
The CAS number of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile is 79084-83-6.
What is the molecular formula of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile?
The molecular formula of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile is C13H11N3O2.
What is the molecular weight of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile?
The molecular weight of 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile is 241.09 g/mol.
Where can I buy 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile?
You can request a quote for 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-1-(phenylamino)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.