N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine
TL;DR: N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine (CAS 1048006-02-5) is a chemical compound with molecular formula C14H19FN2O3 and molecular weight 282.13797 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-(3-fluoroanilino)-2-(2-methylpropylamino)-4-oxobutanoic acid
Also Known As: N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine, (2S)-3-[(3-fluorophenyl)carbamoyl]-2-(2-methylpropylamino)propanoic Acid
Technical Specifications
| Molecular Formula | C14H19FN2O3 |
| Molecular Weight | 282.13797 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 85.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.13797 Da |
| Heavy Atoms | 20 |
| Complexity | 331.0 |
| SMILES | CC(C)CN[C@@H](CC(=O)NC1=CC(=CC=C1)F)C(=O)O |
| InChIKey | XRBIWNDAVMXJQM-LBPRGKRZSA-N |
Chemical Property Profile of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine
Property Insights of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine. The TPSA of 85.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine. Following Lipinski's Rule of Five, N4-(3-Fluorophenyl)-N2-isobutyl-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 N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine?
The CAS number of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine is 1048006-02-5.
What is the molecular formula of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine?
The molecular formula of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine is C14H19FN2O3.
What is the molecular weight of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine?
The molecular weight of N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine is 282.13797 g/mol.
Where can I buy N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine?
You can request a quote for N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine?
Yes, CoreyChem provides custom synthesis services for N4-(3-Fluorophenyl)-N2-isobutyl-L-asparagine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.