C22H23Cl2NO3S
TL;DR: C22H23Cl2NO3S (CAS 573945-25-2) is a chemical compound with molecular formula C22H23Cl2NO3S and molecular weight 451.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2,4-dichlorophenyl)-N-(1,1-dioxothiolan-3-yl)-N-[(4-ethylphenyl)methyl]prop-2-enamide
Also Known As: (2E)-3-(2,4-dichlorophenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)prop-2-enamide, (E)-3-(2,4-dichlorophenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)acrylamide, (E)-3-(2,4-dichlorophenyl)-N-(1,1-dioxothiolan-3-yl)-N-[(4-ethylphenyl)methyl]prop-2-enamide
| Molecular Formula | C22H23Cl2NO3S |
|---|---|
| Molecular Weight | 451.08 g/mol |
| LogP | 4.7849 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.07758 |
| Heavy Atoms | 29 |
| Complexity | 1016.85297 |
Chemical Identifiers
| CAS Number | 573945-25-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)/C=C/C3=C(C=C(C=C3)Cl)Cl |
Product Overview
C22H23Cl2NO3S (CAS 573945-25-2), with molecular formula C22H23Cl2NO3S and molecular weight 451.08 g/mol. IUPAC: (E)-3-(2,4-dichlorophenyl)-N-(1,1-dioxothiolan-3-yl)-N-[(4-ethylphenyl)methyl]prop-2-enamide.
Chemical Property Profile of C22H23Cl2NO3S
Property Insights of C22H23Cl2NO3S
The XLogP value of 4.7849 indicates that C22H23Cl2NO3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, C22H23Cl2NO3S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C22H23Cl2NO3S has 0 hydrogen bond donor(s) and 3 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 C22H23Cl2NO3S?
The CAS number of C22H23Cl2NO3S is 573945-25-2.
What is the molecular formula of C22H23Cl2NO3S?
The molecular formula of C22H23Cl2NO3S is C22H23Cl2NO3S.
What is the molecular weight of C22H23Cl2NO3S?
The molecular weight of C22H23Cl2NO3S is 451.08 g/mol.
Where can I buy C22H23Cl2NO3S?
You can request a quote for C22H23Cl2NO3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H23Cl2NO3S?
Yes, KEHONG BIO provides custom synthesis services for C22H23Cl2NO3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.