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Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate
TL;DR: Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate (CAS 701923-25-3) is a chemical compound with molecular formula C19H20N2O7S and molecular weight 420.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzene-1,4-dicarboxylate
Also Known As: CBKinase1_006721, CBKinase1_019121, AH-487/42566752, BRD-K71324573-001-01-8, dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate
| Molecular Formula | C19H20N2O7S |
|---|---|
| Molecular Weight | 420.10 g/mol |
| LogP | 1.9079 |
| Topological Polar Surface Area | 119.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.09912 |
| Heavy Atoms | 29 |
| Complexity | 1063.9774 |
Chemical Identifiers
| CAS Number | 701923-25-3 |
|---|---|
| SMILES | CN(C1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)S(=O)(=O)C |
Product Overview
Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate (CAS 701923-25-3), with molecular formula C19H20N2O7S and molecular weight 420.10 g/mol. IUPAC: dimethyl 2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate
Property Insights of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate
The XLogP value of 1.9079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate. The TPSA of 119.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate. Following Lipinski's Rule of Five, Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate has 1 hydrogen bond donor(s) and 7 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 Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate?
The CAS number of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate is 701923-25-3.
What is the molecular formula of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate?
The molecular formula of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate is C19H20N2O7S.
What is the molecular weight of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate?
The molecular weight of Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate is 420.10 g/mol.
Where can I buy Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate?
You can request a quote for Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)terephthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.