1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile
TL;DR: 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile (CAS 61296-00-2) 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-(furan-2-ylmethylideneamino)-4,6-dimethyl-2-oxopyridine-3-carbonitrile
Also Known As: 1,2-DIHYDRO-4,6-DIMETHYL-1-FURFURYLIDENEAMINO-2-OXONICOTINONITRILE, 1-(furan-2-ylmethylideneamino)-4,6-dimethyl-2-oxopyridine-3-, 1-(furan-2-ylmethylideneamino)-4,6-dimethyl-2-oxopyridine-3-carbonitrile, 1-[(2-furylmethylene)amino]-4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinecarbonitrile, 1-[(E)-(FURAN-2-YLMETHYLIDENE)AMINO]-4,6-DIMETHYL-2-OXOPYRIDINE-3-CARBONITRILE
| Molecular Formula | C13H11N3O2 |
|---|---|
| Molecular Weight | 241.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.08513 |
| Heavy Atoms | 18 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 61296-00-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=O)N1N=CC2=CC=CO2)C#N)C |
| InChIKey | DWVOZJJPKRMKDG-UHFFFAOYSA-N |
Product Overview
1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile (CAS 61296-00-2), with molecular formula C13H11N3O2 and molecular weight 241.09 g/mol. IUPAC: 1-(furan-2-ylmethylideneamino)-4,6-dimethyl-2-oxopyridine-3-carbonitrile.
Chemical Property Profile of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile
Property Insights of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile. Following Lipinski's Rule of Five, 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile 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 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile?
The CAS number of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile is 61296-00-2.
What is the molecular formula of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile?
The molecular formula of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile is C13H11N3O2.
What is the molecular weight of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile?
The molecular weight of 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile is 241.09 g/mol.
Where can I buy 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile?
You can request a quote for 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile 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-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihydro-4,6-dimethyl-1-furfurylideneamino-2-oxonicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.