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Iodobolpyramine structure
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Iodobolpyramine

TL;DR: Iodobolpyramine (CAS 101395-43-1) is a chemical compound with molecular formula C30H39IN4O3 and molecular weight 628.20685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(4-hydroxy-3-(125I)iodophenyl)-N-[5-[2-[(4-methoxyphenyl)methyl-pyridin-2-ylamino]ethyl-methylamino]pentyl]propanamide

Also Known As: Iodobolpyramine, Isoquinolinium, 2-[(decyloxy)methyl]-, chloride, Isoquinolinium, 2-[(hexyloxy)methyl]-, chloride, Isoquinolinium, 2-[(octyloxy)methyl]-, chloride, Phosphonium, [(octyloxy)methyl]triphenyl-, chloride

CAS Number
101395-43-1
Molecular Formula
C30H39IN4O3
Molecular Weight
628.20685 g/mol
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Technical Specifications

Molecular FormulaC30H39IN4O3
Molecular Weight628.20685 g/mol
XLogP5.8
Topological Polar Surface Area (TPSA)77.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds16
Exact Mass628.20685 Da
Heavy Atoms38
Complexity649.0
SMILESCN(CCCCCNC(=O)CCC1=CC(=C(C=C1)O)[125I])CCN(CC2=CC=C(C=C2)OC)C3=CC=CC=N3
InChIKeyLOPFSGXLOHCWPI-DYSJZCPFSA-N

Chemical Property Profile of Iodobolpyramine

XLogP
5.8
TPSA (Topological Polar Surface Area)
77.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
16
Heavy Atoms
38
Complexity
649.0
Exact Mass
628.20685
Monoisotopic Mass
628.20685
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 Iodobolpyramine

The XLogP value of 5.8 indicates that Iodobolpyramine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Iodobolpyramine. Following Lipinski's Rule of Five, Iodobolpyramine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Iodobolpyramine?

The CAS number of Iodobolpyramine is 101395-43-1.

What is the molecular formula of Iodobolpyramine?

The molecular formula of Iodobolpyramine is C30H39IN4O3.

What is the molecular weight of Iodobolpyramine?

The molecular weight of Iodobolpyramine is 628.20685 g/mol.

Where can I buy Iodobolpyramine?

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

Does CoreyChem offer custom synthesis for Iodobolpyramine?

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

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