2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-
TL;DR: 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- (CAS 92199-46-7) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(N-methylanilino)cyclohexa-2,5-diene-1,4-dione
Also Known As: 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-, 2-methyl-5-(methylanilino)benzo-1,4-quinone, 2-methyl-5-(N-methylanilino)cyclohexa-2,5-diene-1,4-dione, 2-methyl-5-[methyl(phenyl)amino]cyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C14H13NO2 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | 2.1048 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.09464 |
| Heavy Atoms | 17 |
| Complexity | 526.413 |
Chemical Identifiers
| CAS Number | 92199-46-7 |
|---|---|
| SMILES | CC1=CC(=O)C(=CC1=O)N(C)C2=CC=CC=C2 |
Product Overview
2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- (CAS 92199-46-7), with molecular formula C14H13NO2 and molecular weight 227.09 g/mol. IUPAC: 2-methyl-5-(N-methylanilino)cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-
Property Insights of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-
The XLogP value of 2.1048 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-. With a topological polar surface area (TPSA) of 37.38 Ų, 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- 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 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-?
The CAS number of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- is 92199-46-7.
What is the molecular formula of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-?
The molecular formula of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- is C14H13NO2.
What is the molecular weight of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-?
The molecular weight of 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- is 227.09 g/mol.
Where can I buy 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-?
You can request a quote for 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Cyclohexadiene-1,4-dione, 2-methyl-5-(methylphenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.