![[4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate structure](/static/products/3696/369608-31-1.webp)
[4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate
TL;DR: [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate (CAS 369608-31-1) is a chemical compound with molecular formula C23H20N2O5S and molecular weight 436.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate
Also Known As: [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate, (E)-4-(3-amino-2-benzamido-3-oxoprop-1-en-1-yl)phenyl 4-methylbenzenesulfonate, 4-{(1E)-3-amino-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl 4-methylbenzenesulfonate
| Molecular Formula | C23H20N2O5S |
|---|---|
| Molecular Weight | 436.11 g/mol |
| LogP | 3.01892 |
| Topological Polar Surface Area | 115.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 436.10928 |
| Heavy Atoms | 31 |
| Complexity | 1217.2231 |
Chemical Identifiers
| CAS Number | 369608-31-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=C(\C(=O)N)/NC(=O)C3=CC=CC=C3 |
Product Overview
[4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate (CAS 369608-31-1), with molecular formula C23H20N2O5S and molecular weight 436.11 g/mol. IUPAC: [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate.
Chemical Property Profile of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate
Property Insights of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate
The XLogP value of 3.01892 indicates that [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.56 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate has 2 hydrogen bond donor(s) and 5 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-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate?
The CAS number of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate is 369608-31-1.
What is the molecular formula of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate?
The molecular formula of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate is C23H20N2O5S.
What is the molecular weight of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate?
The molecular weight of [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate is 436.11 g/mol.
Where can I buy [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate?
You can request a quote for [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [4-[(E)-3-amino-2-benzamido-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.