Cholecystokinin-J
TL;DR: Cholecystokinin-J (CAS 144396-38-3) is a chemical compound with molecular formula C49H66N6O16S and molecular weight 1026.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-[[(2S)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[[2-[[(2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-sulfooxyphenyl)propanoyl]amino]hexanoyl]amino]acetyl]amino]propanoyl]amino]hexanoyl]amino]-4-oxo-4-(2-phenylethoxy)butanoic acid
Also Known As: Cholecystokinin-J, CCK-J, Boc-tyr(SO3)-nle-gly-tyr-nle-asp-pee, HY-P2424, (3S)-3-[[(2S)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[[2-[[(2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-sulfooxyphenyl)propanoyl]amino]hexanoyl]amino]acetyl]amino]propanoyl]amino]hexanoyl]amino]-4-oxo-4-(2-phenylethoxy)butanoic acid
| Molecular Formula | C49H66N6O16S |
|---|---|
| Molecular Weight | 1026.43 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 340.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 32 |
| Exact Mass | 1026.4257 |
| Heavy Atoms | 72 |
| Complexity | 1870.0 |
Chemical Identifiers
| CAS Number | 144396-38-3 |
|---|---|
| SMILES | CCCC[C@@H](C(=O)NCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC(=O)O)C(=O)OCCC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=C(C=C3)OS(=O)(=O)O)NC(=O)OC(C)(C)C |
| InChIKey | TUDCKMOFZXPUTC-HECCNADXSA-N |
Product Overview
Cholecystokinin-J (CAS 144396-38-3), with molecular formula C49H66N6O16S and molecular weight 1026.43 g/mol. IUPAC: (3S)-3-[[(2S)-2-[[(2S)-3-(4-hydroxyphenyl)-2-[[2-[[(2S)-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-sulfooxyphenyl)propanoyl]amino]hexanoyl]amino]acetyl]amino]propanoyl]amino]hexanoyl]amino]-4-oxo-4-(2-phenylethoxy)butanoic acid.
Chemical Property Profile of Cholecystokinin-J
Property Insights of Cholecystokinin-J
The XLogP value of 5.4 indicates that Cholecystokinin-J is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 340.0 Ų indicates high polarity, suggesting Cholecystokinin-J may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cholecystokinin-J has 9 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cholecystokinin-J?
The CAS number of Cholecystokinin-J is 144396-38-3.
What is the molecular formula of Cholecystokinin-J?
The molecular formula of Cholecystokinin-J is C49H66N6O16S.
What is the molecular weight of Cholecystokinin-J?
The molecular weight of Cholecystokinin-J is 1026.43 g/mol.
Where can I buy Cholecystokinin-J?
You can request a quote for Cholecystokinin-J directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cholecystokinin-J?
Yes, KEHONG BIO provides custom synthesis services for Cholecystokinin-J and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.