(2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide
TL;DR: (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide (CAS 327062-81-7) is a chemical compound with molecular formula C21H11Cl2N3O2S and molecular weight 438.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]prop-2-enamide
Also Known As: (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide, (E)-N-(benzo[d]thiazol-2-yl)-2-cyano-3-(5-(2,5-dichlorophenyl)furan-2-yl)acrylamide, N-benzothiazol-2-yl-2-cyano-3-[5-(2,5-dichlorophenyl)-2-furyl]prop-2-enamide, (2E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]prop-2-enamide, (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]prop-2-enamide
| Molecular Formula | C21H11Cl2N3O2S |
|---|---|
| Molecular Weight | 438.99 g/mol |
| LogP | 6.40878 |
| Topological Polar Surface Area | 78.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.9949 |
| Heavy Atoms | 29 |
| Complexity | 1267.75 |
Chemical Identifiers
| CAS Number | 327062-81-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)Cl)Cl)/C#N |
Product Overview
(2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide (CAS 327062-81-7), with molecular formula C21H11Cl2N3O2S and molecular weight 438.99 g/mol. IUPAC: (E)-N-(1,3-benzothiazol-2-yl)-2-cyano-3-[5-(2,5-dichlorophenyl)furan-2-yl]prop-2-enamide.
Chemical Property Profile of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide
Property Insights of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide
The XLogP value of 6.40878 indicates that (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.92 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide. Following Lipinski's Rule of Five, (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide has 1 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 (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide?
The CAS number of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide is 327062-81-7.
What is the molecular formula of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide?
The molecular formula of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide is C21H11Cl2N3O2S.
What is the molecular weight of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide?
The molecular weight of (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide is 438.99 g/mol.
Where can I buy (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide?
You can request a quote for (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-benzothiazol-2-yl-3-[5-(2,5-dichlorophenyl)(2-furyl)]-2-cyanoprop-2-ena mide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.