达米酮A
TL;DR: 达米酮A (CAS 138683-66-6) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
达米酮A
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, 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-, Pyrrolo[4,3,2-de]quinoline-7,8-dione,1,3,4,5-tetrahydro-1,5-dimethyl-
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 138683-66-6 |
|---|---|
| SMILES | CN1CCC2=CN(C3=C2C1=CC(=O)C3=O)C |
| InChIKey | NWBAIJSXHACZNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
达米酮A (CAS 138683-66-6), with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol. IUPAC: 2,7-dimethyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione.
Chemical Property Profile of 达米酮A
Property Insights of 达米酮A
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 达米酮A. With a topological polar surface area (TPSA) of 42.3 Ų, 达米酮A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 达米酮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
Frequently Asked Questions
What is the CAS number of 达米酮A?
The CAS number of 达米酮A is 138683-66-6.
What is the molecular formula of 达米酮A?
The molecular formula of 达米酮A is C12H12N2O2.
What is the molecular weight of 达米酮A?
The molecular weight of 达米酮A is 216.09 g/mol.
Where can I buy 达米酮A?
You can request a quote for 达米酮A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 达米酮A?
Yes, KEHONG BIO provides custom synthesis services for 达米酮A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.