2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-
TL;DR: 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- (CAS 160893-89-0) is a chemical compound with molecular formula C18H13N3OS and molecular weight 319.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide
Also Known As: 2-Cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-2-propenamide, 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-, N-(4-Methylbenzothiazol-2-yl)-alpha-cyanocinnamamide, (E)-2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide, (2E)-2-CYANO-N-(4-METHYL-1,3-BENZOTHIAZOL-2-YL)-3-PHENYLPROP-2-ENAMIDE
| Molecular Formula | C18H13N3OS |
|---|---|
| Molecular Weight | 319.08 g/mol |
| LogP | 4.1504 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.07794 |
| Heavy Atoms | 23 |
| Complexity | 935.8051 |
Chemical Identifiers
| CAS Number | 160893-89-0 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)SC(=N2)NC(=O)/C(=C/C3=CC=CC=C3)/C#N |
Product Overview
2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- (CAS 160893-89-0), with molecular formula C18H13N3OS and molecular weight 319.08 g/mol. IUPAC: (E)-2-cyano-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide.
Chemical Property Profile of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-
Property Insights of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-
The XLogP value of 4.1504 indicates that 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-. Following Lipinski's Rule of Five, 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- has 1 hydrogen bond donor(s) and 4 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 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-?
The CAS number of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- is 160893-89-0.
What is the molecular formula of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-?
The molecular formula of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- is C18H13N3OS.
What is the molecular weight of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-?
The molecular weight of 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- is 319.08 g/mol.
Where can I buy 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-?
You can request a quote for 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenamide, 2-cyano-N-(4-methyl-2-benzothiazolyl)-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.