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HOE k86-4321 structure
Fine Chemical

HOE k86-4321

TL;DR: HOE k86-4321 (CAS 103412-36-8) is a chemical compound with molecular formula C56H83N19O13S2 and molecular weight 1293.5859 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S,4R)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-4-hydroxypyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-3-thiophen-2-ylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid

Also Known As: Ahtp-BK, Hoe k86-4321, Hoe-k86-4321, Arg-hyp-pro-gly-thi-ser-phe-thi-arg, 2-Hyp-5,8-(thi-ala)-7-phe-bradykinin

CAS Number
103412-36-8
Molecular Formula
C56H83N19O13S2
Molecular Weight
1293.5859 g/mol
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Technical Specifications

Molecular FormulaC56H83N19O13S2
Molecular Weight1293.5859 g/mol
XLogP-6.5
Topological Polar Surface Area (TPSA)598.0 Ų
Hydrogen Bond Donors17
Hydrogen Bond Acceptors19
Rotatable Bonds36
Exact Mass1293.5859 Da
Heavy Atoms90
Complexity2540.0
SMILESC1C[C@H](N(C1)C(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)N)O)C(=O)NCC(=O)N[C@@H](CC3=CC=CS3)C(=O)N[C@@H](CO)C(=O)N[C@H](CC4=CC=CC=C4)C(=O)N[C@@H](CC5=CC=CS5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O
InChIKeyULGMPJSHNJQEJC-VDMFLOONSA-N

Product Description

Applications: HOE k86-4321 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, HOE k86-4321 (CAS 103412-36-8) has the molecular formula C56H83N19O13S2 and a molecular weight of 1293.59 g/mol. Synonyms include Ahtp-BK and Hoe k86-4321.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of HOE k86-4321

XLogP
-6.5
TPSA (Topological Polar Surface Area)
598.0
Hydrogen Bond Donors
17
Hydrogen Bond Acceptors
19
Rotatable Bonds
36
Heavy Atoms
90
Complexity
2540.0
Exact Mass
1293.5859
Monoisotopic Mass
1293.5859
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of HOE k86-4321

The XLogP value of -6.5 indicates that HOE k86-4321 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 598.0 Ų indicates high polarity, suggesting HOE k86-4321 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, HOE k86-4321 has 17 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of HOE k86-4321?

The CAS number of HOE k86-4321 is 103412-36-8.

What is the molecular formula of HOE k86-4321?

The molecular formula of HOE k86-4321 is C56H83N19O13S2.

What is the molecular weight of HOE k86-4321?

The molecular weight of HOE k86-4321 is 1293.5859 g/mol.

What are the applications of HOE k86-4321?

HOE k86-4321 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy HOE k86-4321?

You can request a quote for HOE k86-4321 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for HOE k86-4321?

Yes, CoreyChem provides custom synthesis services for HOE k86-4321 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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