(E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate
TL;DR: (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate (CAS 385810-59-3) is a chemical compound with molecular formula C30H26N2O5S and molecular weight 526.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-benzamido-3-(4-methylanilino)-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate
Also Known As: (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate, [4-[(E)-2-benzamido-3-(4-methylanilino)-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate, 4-{(1E)-3-[(4-methylphenyl)amino]-3-oxo-2-[(phenylcarbonyl)amino]prop-1-en-1-yl}phenyl 4-methylbenzenesulfonate
| Molecular Formula | C30H26N2O5S |
|---|---|
| Molecular Weight | 526.16 g/mol |
| LogP | 5.48074 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 526.15625 |
| Heavy Atoms | 38 |
| Complexity | 1560.98 |
Chemical Identifiers
| CAS Number | 385810-59-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)/NC(=O)C4=CC=CC=C4 |
Product Overview
(E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate (CAS 385810-59-3), with molecular formula C30H26N2O5S and molecular weight 526.16 g/mol. IUPAC: [4-[(E)-2-benzamido-3-(4-methylanilino)-3-oxoprop-1-enyl]phenyl] 4-methylbenzenesulfonate.
Chemical Property Profile of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate
Property Insights of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate
The XLogP value of 5.48074 indicates that (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate?
The CAS number of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate is 385810-59-3.
What is the molecular formula of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate?
The molecular formula of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate is C30H26N2O5S.
What is the molecular weight of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate?
The molecular weight of (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate is 526.16 g/mol.
Where can I buy (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate?
You can request a quote for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)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 (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-(2-benzamido-3-oxo-3-(p-tolylamino)prop-1-en-1-yl)phenyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.