N-(8-amino-1-carboxyoctyl)-alanyl-proline
TL;DR: N-(8-amino-1-carboxyoctyl)-alanyl-proline (CAS 120008-53-9) is a chemical compound with molecular formula C17H31N3O5 and molecular weight 357.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[(2S)-2-[[(1S)-8-amino-1-carboxyoctyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
Also Known As: AB 47, N-(8-amino-1-carboxyoctyl)-alanyl-proline, N-(8-Amino-1-carboxyoctyl)alanylproline, N-(8-Amino-1(S)-carboxyoctyl)-L-alanyl-L-proline, SID:134223917
| Molecular Formula | C17H31N3O5 |
|---|---|
| Molecular Weight | 357.23 g/mol |
| LogP | 0.7926 |
| Topological Polar Surface Area | 132.96 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 357.22638 |
| Heavy Atoms | 25 |
| Complexity | 457.56427 |
Chemical Identifiers
| CAS Number | 120008-53-9 |
|---|---|
| SMILES | C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N[C@@H](CCCCCCCN)C(=O)O |
Product Overview
N-(8-amino-1-carboxyoctyl)-alanyl-proline (CAS 120008-53-9), with molecular formula C17H31N3O5 and molecular weight 357.23 g/mol. IUPAC: (2S)-1-[(2S)-2-[[(1S)-8-amino-1-carboxyoctyl]amino]propanoyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of N-(8-amino-1-carboxyoctyl)-alanyl-proline
Property Insights of N-(8-amino-1-carboxyoctyl)-alanyl-proline
The XLogP value of 0.7926 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(8-amino-1-carboxyoctyl)-alanyl-proline. The TPSA of 132.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(8-amino-1-carboxyoctyl)-alanyl-proline. Following Lipinski's Rule of Five, N-(8-amino-1-carboxyoctyl)-alanyl-proline has 4 hydrogen bond donor(s) and 5 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 N-(8-amino-1-carboxyoctyl)-alanyl-proline?
The CAS number of N-(8-amino-1-carboxyoctyl)-alanyl-proline is 120008-53-9.
What is the molecular formula of N-(8-amino-1-carboxyoctyl)-alanyl-proline?
The molecular formula of N-(8-amino-1-carboxyoctyl)-alanyl-proline is C17H31N3O5.
What is the molecular weight of N-(8-amino-1-carboxyoctyl)-alanyl-proline?
The molecular weight of N-(8-amino-1-carboxyoctyl)-alanyl-proline is 357.23 g/mol.
Where can I buy N-(8-amino-1-carboxyoctyl)-alanyl-proline?
You can request a quote for N-(8-amino-1-carboxyoctyl)-alanyl-proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(8-amino-1-carboxyoctyl)-alanyl-proline?
Yes, KEHONG BIO provides custom synthesis services for N-(8-amino-1-carboxyoctyl)-alanyl-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.