N2-Allyl-N4-(pyridin-3-yl)-L-asparagine
TL;DR: N2-Allyl-N4-(pyridin-3-yl)-L-asparagine (CAS 1047680-96-5) is a chemical compound with molecular formula C12H15N3O3 and molecular weight 249.11134 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-oxo-2-(prop-2-enylamino)-4-(pyridin-3-ylamino)butanoic acid
Also Known As: N2-Allyl-N4-(pyridin-3-yl)-L-asparagine, (2R)-2-(prop-2-enylamino)-3-(pyridin-3-ylcarbamoyl)propanoic Acid
Technical Specifications
| Molecular Formula | C12H15N3O3 |
| Molecular Weight | 249.11134 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 98.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 249.11134 Da |
| Heavy Atoms | 18 |
| Complexity | 301.0 |
| SMILES | C=CCN[C@@H](CC(=O)NC1=CN=CC=C1)C(=O)O |
| InChIKey | BWJDKSOYBJVIKS-JTQLQIEISA-N |
Chemical Property Profile of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine
Property Insights of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine
The XLogP value of -1.3 indicates that N2-Allyl-N4-(pyridin-3-yl)-L-asparagine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N2-Allyl-N4-(pyridin-3-yl)-L-asparagine. Following Lipinski's Rule of Five, N2-Allyl-N4-(pyridin-3-yl)-L-asparagine 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
What is the CAS number of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine?
The CAS number of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine is 1047680-96-5.
What is the molecular formula of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine?
The molecular formula of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine is C12H15N3O3.
What is the molecular weight of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine?
The molecular weight of N2-Allyl-N4-(pyridin-3-yl)-L-asparagine is 249.11134 g/mol.
Where can I buy N2-Allyl-N4-(pyridin-3-yl)-L-asparagine?
You can request a quote for N2-Allyl-N4-(pyridin-3-yl)-L-asparagine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N2-Allyl-N4-(pyridin-3-yl)-L-asparagine?
Yes, CoreyChem provides custom synthesis services for N2-Allyl-N4-(pyridin-3-yl)-L-asparagine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.