6,7-Dimethyllumazine
TL;DR: 6,7-Dimethyllumazine (CAS 5774-36-7) is a chemical compound with molecular formula C28H23F3N2O5S2 and molecular weight 588.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)sulfonyl-N-[2-[(4-methylphenyl)sulfonylamino]phenyl]-4-(trifluoromethyl)benzamide
Also Known As: 6,7-Dimethyllumazine, N-(4-methylphenyl)sulfonyl-N-[2-[(4-methylphenyl)sulfonylamino]phenyl]-4-(trifluoromethyl)benzamide, A2738/0116284, N-(4-Methylbenzene-1-sulfonyl)-N-{2-[(4-methylbenzene-1-sulfonyl)amino]phenyl}-4-(trifluoromethyl)benzamide, N-[(4-methylphenyl)sulfonyl]-N-(2-{[(4-methylphenyl)sulfonyl]amino}phenyl)-4-(trifluoromethyl)benzamide
| Molecular Formula | C28H23F3N2O5S2 |
|---|---|
| Molecular Weight | 588.10 g/mol |
| LogP | 6.15874 |
| Topological Polar Surface Area | 100.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 588.10004 |
| Heavy Atoms | 40 |
| Complexity | 1752.8723 |
Chemical Identifiers
| CAS Number | 5774-36-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2N(C(=O)C3=CC=C(C=C3)C(F)(F)F)S(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
6,7-Dimethyllumazine (CAS 5774-36-7), with molecular formula C28H23F3N2O5S2 and molecular weight 588.10 g/mol. IUPAC: N-(4-methylphenyl)sulfonyl-N-[2-[(4-methylphenyl)sulfonylamino]phenyl]-4-(trifluoromethyl)benzamide.
Chemical Property Profile of 6,7-Dimethyllumazine
Property Insights of 6,7-Dimethyllumazine
The XLogP value of 6.15874 indicates that 6,7-Dimethyllumazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dimethyllumazine. Following Lipinski's Rule of Five, 6,7-Dimethyllumazine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6,7-Dimethyllumazine?
The CAS number of 6,7-Dimethyllumazine is 5774-36-7.
What is the molecular formula of 6,7-Dimethyllumazine?
The molecular formula of 6,7-Dimethyllumazine is C28H23F3N2O5S2.
What is the molecular weight of 6,7-Dimethyllumazine?
The molecular weight of 6,7-Dimethyllumazine is 588.10 g/mol.
Where can I buy 6,7-Dimethyllumazine?
You can request a quote for 6,7-Dimethyllumazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dimethyllumazine?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethyllumazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.