4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile
TL;DR: 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile (CAS 303997-26-4) is a chemical compound with molecular formula C13H10F2N4O2 and molecular weight 292.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile
Also Known As: 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile, 4-[(2,4-difluorophenyl)amino]-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile, 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile, 4-[(2,4-difluorophenyl)amino]-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile, C13H10F2N4O2
| Molecular Formula | C13H10F2N4O2 |
|---|---|
| Molecular Weight | 292.08 g/mol |
| LogP | 1.99428 |
| Topological Polar Surface Area | 82.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.07718 |
| Heavy Atoms | 21 |
| Complexity | 780.7163 |
Chemical Identifiers
| CAS Number | 303997-26-4 |
|---|---|
| SMILES | CN(C)C1=NC(=C(C(=O)O1)C#N)NC2=C(C=C(C=C2)F)F |
Product Overview
4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile (CAS 303997-26-4), with molecular formula C13H10F2N4O2 and molecular weight 292.08 g/mol. IUPAC: 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile.
Chemical Property Profile of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile
Property Insights of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile
The XLogP value of 1.99428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile. The TPSA of 82.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile. Following Lipinski's Rule of Five, 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile 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 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
The CAS number of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile is 303997-26-4.
What is the molecular formula of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
The molecular formula of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile is C13H10F2N4O2.
What is the molecular weight of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
The molecular weight of 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile is 292.08 g/mol.
Where can I buy 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
You can request a quote for 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,4-difluoroanilino)-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.