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Damirone A structure
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Damirone A

TL;DR: Damirone A (CAS 138683-66-6) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,7-dimethyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione

Also Known As: Damirone A, dimethyl[?]dione, KST-1B0415, 1,5-dimethyl-1,3,4,5-tetrahydropyrrolo[4,3,2-de]quinoline-7,8-dione, Pyrrolo(4,3,2-de)quinoline-7,8-dione, 1,3,4,5-tetrahydro-1,5-dimethyl-

CAS Number
138683-66-6
Molecular Formula
C12H12N2O2
Molecular Weight
216.08987 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC12H12N2O2
Molecular Weight216.08987 g/mol
XLogP0.4
Topological Polar Surface Area (TPSA)42.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds0
Exact Mass216.08987 Da
Heavy Atoms16
Complexity402.0
SMILESCN1CCC2=CN(C3=C2C1=CC(=O)C3=O)C
InChIKeyNWBAIJSXHACZNH-UHFFFAOYSA-N

Chemical Property Profile of Damirone A

XLogP
0.4
TPSA (Topological Polar Surface Area)
42.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
16
Complexity
402.0
Exact Mass
216.08987
Monoisotopic Mass
216.08987
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 Damirone A

The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Damirone A. With a topological polar surface area (TPSA) of 42.3 Ų, Damirone A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Damirone A has 0 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 Damirone A?

The CAS number of Damirone A is 138683-66-6.

What is the molecular formula of Damirone A?

The molecular formula of Damirone A is C12H12N2O2.

What is the molecular weight of Damirone A?

The molecular weight of Damirone A is 216.08987 g/mol.

Where can I buy Damirone A?

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

Does CoreyChem offer custom synthesis for Damirone A?

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

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