(E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide
TL;DR: (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide (CAS 326087-67-6) is a chemical compound with molecular formula C20H17N3O2S and molecular weight 363.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide
Also Known As: (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide, 2-cyano-N-(3,6-dimethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide
| Molecular Formula | C20H17N3O2S |
|---|---|
| Molecular Weight | 363.10 g/mol |
| LogP | 3.5913 |
| Topological Polar Surface Area | 67.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.10416 |
| Heavy Atoms | 26 |
| Complexity | 1112.6492 |
Chemical Identifiers
| CAS Number | 326087-67-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=NC(=O)/C(=C/C3=CC=C(C=C3)OC)/C#N)S2)C |
Product Overview
(E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide (CAS 326087-67-6), with molecular formula C20H17N3O2S and molecular weight 363.10 g/mol. IUPAC: (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide
Property Insights of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide
The XLogP value of 3.5913 indicates that (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.38 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide has 0 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 (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide?
The CAS number of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide is 326087-67-6.
What is the molecular formula of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide?
The molecular formula of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide is C20H17N3O2S.
What is the molecular weight of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide?
The molecular weight of (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide is 363.10 g/mol.
Where can I buy (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide?
You can request a quote for (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.