N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine
TL;DR: N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine (CAS 1029938-81-5) is a chemical compound with molecular formula C16H23ClN2O3 and molecular weight 326.1397 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-(4-chloroanilino)-2-(hexylamino)-4-oxobutanoic acid
Also Known As: N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine, (2S)-4-(4-chloroanilino)-2-(hexylamino)-4-oxobutanoic acid, (2S)-3-[(4-chlorophenyl)carbamoyl]-2-(hexylamino)propanoic Acid
Technical Specifications
| Molecular Formula | C16H23ClN2O3 |
| Molecular Weight | 326.1397 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 85.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 326.1397 Da |
| Heavy Atoms | 22 |
| Complexity | 339.0 |
| SMILES | CCCCCCN[C@@H](CC(=O)NC1=CC=C(C=C1)Cl)C(=O)O |
| InChIKey | YYHQIDCWKXEVRA-AWEZNQCLSA-N |
Chemical Property Profile of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine
Property Insights of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine. The TPSA of 85.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine. Following Lipinski's Rule of Five, N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine has 2 hydrogen bond donor(s) and 3 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-(4-Chlorophenyl)-N2-hexyl-L-asparagine?
The CAS number of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine is 1029938-81-5.
What is the molecular formula of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine?
The molecular formula of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine is C16H23ClN2O3.
What is the molecular weight of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine?
The molecular weight of N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine is 326.1397 g/mol.
Where can I buy N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine?
You can request a quote for N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine?
Yes, CoreyChem provides custom synthesis services for N4-(4-Chlorophenyl)-N2-hexyl-L-asparagine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.