(4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate
TL;DR: (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate (CAS 473397-62-5) is a chemical compound with molecular formula C19H20N4O5S and molecular weight 416.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate
Also Known As: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate, (4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate, (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl 4-(N,N-diethylsulfamoyl)benzoate, (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate, 4-(diethylsulfamoyl)benzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester
| Molecular Formula | C19H20N4O5S |
|---|---|
| Molecular Weight | 416.12 g/mol |
| LogP | 1.6365 |
| Topological Polar Surface Area | 111.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.11545 |
| Heavy Atoms | 29 |
| Complexity | 1185.1951 |
Chemical Identifiers
| CAS Number | 473397-62-5 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2 |
Product Overview
(4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate (CAS 473397-62-5), with molecular formula C19H20N4O5S and molecular weight 416.12 g/mol. IUPAC: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate.
Chemical Property Profile of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate
Property Insights of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate
The XLogP value of 1.6365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate. The TPSA of 111.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate. Following Lipinski's Rule of Five, (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate has 0 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 (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate?
The CAS number of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate is 473397-62-5.
What is the molecular formula of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate?
The molecular formula of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate is C19H20N4O5S.
What is the molecular weight of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate?
The molecular weight of (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate is 416.12 g/mol.
Where can I buy (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate?
You can request a quote for (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Oxo-1,2,3-benzotriazin-3-yl)methyl 4-(diethylsulfamoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.