4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate
TL;DR: 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate (CAS 861147-06-0) is a chemical compound with molecular formula C19H21NO6S and molecular weight 391.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-(diethylsulfamoyl)benzoyl]oxybenzoate
Also Known As: methyl 4-[4-(diethylsulfamoyl)benzoyl]oxybenzoate, 4-(methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate, 4-(methoxycarbonyl)phenyl 4-(N,N-diethylsulfamoyl)benzoate
| Molecular Formula | C19H21NO6S |
|---|---|
| Molecular Weight | 391.11 g/mol |
| LogP | 2.7229 |
| Topological Polar Surface Area | 89.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 391.10895 |
| Heavy Atoms | 27 |
| Complexity | 900.221 |
Chemical Identifiers
| CAS Number | 861147-06-0 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC |
Product Overview
4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate (CAS 861147-06-0), with molecular formula C19H21NO6S and molecular weight 391.11 g/mol. IUPAC: methyl 4-[4-(diethylsulfamoyl)benzoyl]oxybenzoate.
Chemical Property Profile of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate
Property Insights of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate
The XLogP value of 2.7229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate. The TPSA of 89.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate. Following Lipinski's Rule of Five, 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate has 0 hydrogen bond donor(s) and 6 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-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate?
The CAS number of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate is 861147-06-0.
What is the molecular formula of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate?
The molecular formula of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate is C19H21NO6S.
What is the molecular weight of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate?
The molecular weight of 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate is 391.11 g/mol.
Where can I buy 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate?
You can request a quote for 4-(Methoxycarbonyl)phenyl 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-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methoxycarbonyl)phenyl 4-(diethylsulfamoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.