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Hydroethidine structure
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Hydroethidine

TL;DR: Hydroethidine (CAS 38483-26-0) is a chemical compound with molecular formula C21H21N3 and molecular weight 315.17355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-ethyl-6-phenyl-5,6-dihydrobenzo[h]isoquinoline-4,8-diamine

Also Known As: Hydroethidine, Reduced ethidium, Dihydroethidium (Hydroethidium), 5,6-Dihydro-3,8-diamino-5-ethyl-6-phenylphenanthridine, 5-ethyl-6-phenyl-5,6-dihydrobenzo[h]isoquinoline-4,8-diamine

CAS Number
38483-26-0
Molecular Formula
C21H21N3
Molecular Weight
315.17355 g/mol
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Technical Specifications

Molecular FormulaC21H21N3
Molecular Weight315.17355 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)64.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass315.17355 Da
Heavy Atoms24
Complexity419.0
SMILESCCC1C(C2=C(C=CC(=C2)N)C3=CN=CC(=C13)N)C4=CC=CC=C4
InChIKeyZDWPSSBKIMIPMY-UHFFFAOYSA-N

Chemical Property Profile of Hydroethidine

XLogP
3.7
TPSA (Topological Polar Surface Area)
64.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
24
Complexity
419.0
Exact Mass
315.17355
Monoisotopic Mass
315.17355
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 Hydroethidine

The XLogP value of 3.7 indicates that Hydroethidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroethidine. Following Lipinski's Rule of Five, Hydroethidine 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 Hydroethidine?

The CAS number of Hydroethidine is 38483-26-0.

What is the molecular formula of Hydroethidine?

The molecular formula of Hydroethidine is C21H21N3.

What is the molecular weight of Hydroethidine?

The molecular weight of Hydroethidine is 315.17355 g/mol.

Where can I buy Hydroethidine?

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

Does CoreyChem offer custom synthesis for Hydroethidine?

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

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