Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate
TL;DR: Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate (CAS 432524-83-9) is a chemical compound with molecular formula C20H23N3O8S and molecular weight 465.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl]-5-nitrobenzoate
Also Known As: methyl 3-[[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl]-5-nitrobenzoate, methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate, methyl 3-((5-(N,N-diethylsulfamoyl)-2-methoxyphenyl)carbamoyl)-5-nitrobenzoate, Methyl 3-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamoyl]-5-nitro-benzoate, methyl 5-(N-{5-[(diethylamino)sulfonyl]-2-methoxyphenyl}carbamoyl)-3-nitrobenz oate
| Molecular Formula | C20H23N3O8S |
|---|---|
| Molecular Weight | 465.12 g/mol |
| LogP | 2.6728 |
| Topological Polar Surface Area | 145.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 465.12057 |
| Heavy Atoms | 32 |
| Complexity | 1143.529 |
Chemical Identifiers
| CAS Number | 432524-83-9 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC |
Product Overview
Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate (CAS 432524-83-9), with molecular formula C20H23N3O8S and molecular weight 465.12 g/mol. IUPAC: methyl 3-[[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl]-5-nitrobenzoate.
Chemical Property Profile of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate
Property Insights of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate
The XLogP value of 2.6728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate. The TPSA of 145.15 Ų indicates high polarity, suggesting Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate has 1 hydrogen bond donor(s) and 8 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 Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate?
The CAS number of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate is 432524-83-9.
What is the molecular formula of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate?
The molecular formula of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate is C20H23N3O8S.
What is the molecular weight of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate?
The molecular weight of Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate is 465.12 g/mol.
Where can I buy Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate?
You can request a quote for Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-{[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamoyl}-5-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.