ER 3826
TL;DR: ER 3826 (CAS 134907-17-8) is a chemical compound with molecular formula C29H33N3O5S2 and molecular weight 567.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[4-[(1-benzylpiperidin-4-yl)sulfamoyl]phenyl]-N-methyl-3-(4-methylsulfonylphenyl)prop-2-enamide
Also Known As: ER 3826, (E)-N-[4-[(1-benzylpiperidin-4-yl)sulfamoyl]phenyl]-N-methyl-3-(4-methylsulfonylphenyl)prop-2-enamide, N-(1-Benzyl-4-piperidinyl)-4-(N-methyl-N-3-(4-(methylsulfonyl)phenyl-2-propenoyl)amino)benzenesulfonamide, N-Methyl-4-methylsulfonyl-N-[4-[1-benzyl-4-piperidinylsulfamoyl]phenyl]-trans-cinnamamide, (2E)-N-{4-[(1-benzylpiperidin-4-yl)sulfamoyl]phenyl}-3-(4-methanesulfonylphenyl)-N-methylprop-2-enamide
| Molecular Formula | C29H33N3O5S2 |
|---|---|
| Molecular Weight | 567.19 g/mol |
| LogP | 3.7092 |
| Topological Polar Surface Area | 103.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 567.18616 |
| Heavy Atoms | 39 |
| Complexity | 1511.997 |
Chemical Identifiers
| CAS Number | 134907-17-8 |
|---|---|
| SMILES | CN(C1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)CC3=CC=CC=C3)C(=O)/C=C/C4=CC=C(C=C4)S(=O)(=O)C |
Product Overview
ER 3826 (CAS 134907-17-8), with molecular formula C29H33N3O5S2 and molecular weight 567.19 g/mol. IUPAC: (E)-N-[4-[(1-benzylpiperidin-4-yl)sulfamoyl]phenyl]-N-methyl-3-(4-methylsulfonylphenyl)prop-2-enamide.
Chemical Property Profile of ER 3826
Property Insights of ER 3826
The XLogP value of 3.7092 indicates that ER 3826 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ER 3826. Following Lipinski's Rule of Five, ER 3826 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ER 3826?
The CAS number of ER 3826 is 134907-17-8.
What is the molecular formula of ER 3826?
The molecular formula of ER 3826 is C29H33N3O5S2.
What is the molecular weight of ER 3826?
The molecular weight of ER 3826 is 567.19 g/mol.
Where can I buy ER 3826?
You can request a quote for ER 3826 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ER 3826?
Yes, KEHONG BIO provides custom synthesis services for ER 3826 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.