![(E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide structure](/static/products/3391/339105-35-0.webp)
(E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide
TL;DR: (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide (CAS 339105-35-0) is a chemical compound with molecular formula C17H15ClF3N3O4S and molecular weight 449.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]ethenesulfonamide
Also Known As: (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide, 2-(1,3-benzodioxol-5-yl)-N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]ethenesulfonamide
| Molecular Formula | C17H15ClF3N3O4S |
|---|---|
| Molecular Weight | 449.04 g/mol |
| LogP | 3.4847 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.0424 |
| Heavy Atoms | 29 |
| Complexity | 1029.0686 |
Chemical Identifiers
| CAS Number | 339105-35-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=CS(=O)(=O)NCCNC3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
(E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide (CAS 339105-35-0), with molecular formula C17H15ClF3N3O4S and molecular weight 449.04 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]ethenesulfonamide.
Chemical Property Profile of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide
Property Insights of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide
The XLogP value of 3.4847 indicates that (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide. Following Lipinski's Rule of Five, (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide has 2 hydrogen bond donor(s) and 6 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 (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide?
The CAS number of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide is 339105-35-0.
What is the molecular formula of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide?
The molecular formula of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide is C17H15ClF3N3O4S.
What is the molecular weight of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide?
The molecular weight of (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide is 449.04 g/mol.
Where can I buy (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide?
You can request a quote for (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(1,3-benzodioxol-5-yl)-N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-1-ethenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.