11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid
TL;DR: 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid (CAS 1217525-98-8) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
15,15-dimethyl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4,6,8,10-pentaene-1-carboxylic acid
Also Known As: BAS 09976627, 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid, 11,11-Dimethyl-3,4-dihydro-2H-1,4-methano-phenazine-1-carboxylic acid, (1S,4S)-11,11-dimethyl-1,2,3,4-tetrahydro-1,4-methanophenazine-1-carboxylic acid, 15,15-dimethyl-3,10-diazatetracyclo[10.2.1.0<2,11>.0<4,9>]pentadeca-2(11),3,5, 7,9-pentaenecarboxylic acid
Technical Specifications
| Molecular Formula | C16H16N2O2 |
| Molecular Weight | 268.1212 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 63.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.1212 Da |
| Heavy Atoms | 20 |
| Complexity | 450.0 |
| SMILES | CC1(C2CCC1(C3=NC4=CC=CC=C4N=C23)C(=O)O)C |
| InChIKey | BQKUSHXRZXVBJL-UHFFFAOYSA-N |
Chemical Property Profile of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid
Property Insights of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11,11-dimethyl-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 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid. Following Lipinski's Rule of Five, 11,11-dimethyl-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 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
The CAS number of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid is 1217525-98-8.
What is the molecular formula of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
The molecular formula of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid is C16H16N2O2.
What is the molecular weight of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
The molecular weight of 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid is 268.1212 g/mol.
Where can I buy 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
You can request a quote for 11,11-dimethyl-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 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 11,11-dimethyl-3,4-dihydro-1,4-methanophenazine-1(2H)-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.