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Ethanol lumiflavine structure
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Ethanol lumiflavine

TL;DR: Ethanol lumiflavine (CAS 3180-56-1) is a chemical compound with molecular formula C14H14N4O3 and molecular weight 286.1066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

10-(2-hydroxyethyl)-7,8-dimethylbenzo[g]pteridine-2,4-dione

Also Known As: Ethanol lumiflavine, hydroxyethylflavine, 10-Hydroxyethylflavin, 7,8-Dhei, Isoalloxazine,8-dimethyl-

CAS Number
3180-56-1
Molecular Formula
C14H14N4O3
Molecular Weight
286.1066 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Pharmaceutical Intermediates (3 patents)

Technical Specifications

Molecular FormulaC14H14N4O3
Molecular Weight286.1066 g/mol
XLogP0.4
Topological Polar Surface Area (TPSA)94.4 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass286.1066 Da
Heavy Atoms21
Complexity542.0
SMILESCC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CCO
InChIKeyMYNIJFMVMJFIPZ-UHFFFAOYSA-N

Chemical Property Profile of Ethanol lumiflavine

XLogP
0.4
TPSA (Topological Polar Surface Area)
94.4
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
21
Complexity
542.0
Exact Mass
286.1066
Monoisotopic Mass
286.1066
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 Ethanol lumiflavine

The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol lumiflavine. The TPSA of 94.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanol lumiflavine. Following Lipinski's Rule of Five, Ethanol lumiflavine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Ethanol lumiflavine?

The CAS number of Ethanol lumiflavine is 3180-56-1.

What is the molecular formula of Ethanol lumiflavine?

The molecular formula of Ethanol lumiflavine is C14H14N4O3.

What is the molecular weight of Ethanol lumiflavine?

The molecular weight of Ethanol lumiflavine is 286.1066 g/mol.

Where can I buy Ethanol lumiflavine?

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

Does CoreyChem offer custom synthesis for Ethanol lumiflavine?

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

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