4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid
TL;DR: 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid (CAS 1217517-48-0) is a chemical compound with molecular formula C17H18N2O2 and molecular weight 282.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
12,15,15-trimethyl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4,6,8,10-pentaene-1-carboxylic acid
Also Known As: AF-399/42176866, 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid, BRD-A83209001-001-01-1, 1,4-Methanophenazine-1(2H)-carboxylic acid, 3,4-dihydro-4,11,11-trimethyl-, 3,4-Dihydro-4,11,11-trimethyl-1,4-methanophenazine-1(2H)-carboxylic acid
Technical Specifications
| Molecular Formula | C17H18N2O2 |
| Molecular Weight | 282.13684 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 63.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.13684 Da |
| Heavy Atoms | 21 |
| Complexity | 491.0 |
| SMILES | CC1(C2(CCC1(C3=NC4=CC=CC=C4N=C32)C(=O)O)C)C |
| InChIKey | LUUJHZGITMOXBL-UHFFFAOYSA-N |
Chemical Property Profile of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid
Property Insights of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid. The TPSA of 63.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid. Following Lipinski's Rule of Five, 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid has 1 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 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
The CAS number of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid is 1217517-48-0.
What is the molecular formula of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
The molecular formula of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid is C17H18N2O2.
What is the molecular weight of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
The molecular weight of 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid is 282.13684 g/mol.
Where can I buy 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
You can request a quote for 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 4,11,11-trimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.