4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile
TL;DR: 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile (CAS 132164-90-0) is a chemical compound with molecular formula C13H12N4O2 and molecular weight 256.09604 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-anilino-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile
Also Known As: 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile, 2-(dimethylamino)-6-oxo-4-(phenylamino)-6H-1,3-oxazine-5-carbonitrile, 4-anilino-2-(dimethylamino)-6-oxo-1,3-oxazine-5-carbonitrile, 11E-900, 2-(dimethylamino)-6-oxo-4-(phenylamino)-1,3-oxazine-5-carbonitrile
Technical Specifications
| Molecular Formula | C13H12N4O2 |
| Molecular Weight | 256.09604 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 77.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.09604 Da |
| Heavy Atoms | 19 |
| Complexity | 478.0 |
| SMILES | CN(C)C1=NC(=C(C(=O)O1)C#N)NC2=CC=CC=C2 |
| InChIKey | PPGOJEDKHJPXOR-UHFFFAOYSA-N |
Chemical Property Profile of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile
Property Insights of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile. Following Lipinski's Rule of Five, 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
The CAS number of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile is 132164-90-0.
What is the molecular formula of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
The molecular formula of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile is C13H12N4O2.
What is the molecular weight of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
The molecular weight of 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile is 256.09604 g/mol.
Where can I buy 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
You can request a quote for 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 4-anilino-2-(dimethylamino)-6-oxo-6H-1,3-oxazine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.