![[2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate structure](/static/products/7224/722477-77-2.webp)
[2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate
TL;DR: [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate (CAS 722477-77-2) is a chemical compound with molecular formula C23H27N3O7S and molecular weight 489.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate
Also Known As: [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate|[3-(4,5,6,7-tetrahydro-3H-azepin-2-ylsulfamoyl)phenyl]carbamoylmethyl 3,5-dimethoxybenzoate|2-Oxo-2-{3-[(3,4,5,6-tetrahydro-2H-azepin-7-yl)sulfamoyl]anilino}ethyl 3,5-dimethoxybenzoate|MLS002246603|SMR001310211
| Molecular Formula | C23H27N3O7S |
|---|---|
| Molecular Weight | 489.16 g/mol |
| LogP | 2.7501 |
| Topological Polar Surface Area | 132.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.15698 |
| Heavy Atoms | 34 |
| Complexity | 1156.5863 |
Chemical Identifiers
| CAS Number | 722477-77-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=NCCCCC3)OC |
Product Overview
[2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate (CAS 722477-77-2), with molecular formula C23H27N3O7S and molecular weight 489.16 g/mol. IUPAC: [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate.
Chemical Property Profile of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate
Property Insights of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate
The XLogP value of 2.7501 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate. The TPSA of 132.39 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate. Following Lipinski's Rule of Five, [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate has 2 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 [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate?
The CAS number of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate is 722477-77-2.
What is the molecular formula of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate?
The molecular formula of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate is C23H27N3O7S.
What is the molecular weight of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate?
The molecular weight of [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate is 489.16 g/mol.
Where can I buy [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate?
You can request a quote for [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-oxo-2-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)anilino]ethyl] 3,5-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.