![(2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide structure](/static/products/956/956684-13-2.png)
(2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide
TL;DR: (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide (CAS 956684-13-2) is a chemical compound with molecular formula C20H16N4OS and molecular weight 360.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enethioamide
Also Known As: (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide, (2E)-2-(aminothioxomethyl)-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2- enenitrile, (E)-2-cyano-3-(3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)prop-2-enethioamide, (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enethioamide
| Molecular Formula | C20H16N4OS |
|---|---|
| Molecular Weight | 360.10 g/mol |
| LogP | 3.74098 |
| Topological Polar Surface Area | 76.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.1045 |
| Heavy Atoms | 26 |
| Complexity | 998.54047 |
Chemical Identifiers
| CAS Number | 956684-13-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=S)N)C3=CC=CC=C3 |
Product Overview
(2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide (CAS 956684-13-2), with molecular formula C20H16N4OS and molecular weight 360.10 g/mol. IUPAC: (E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enethioamide.
Chemical Property Profile of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide
Property Insights of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide
The XLogP value of 3.74098 indicates that (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide. Following Lipinski's Rule of Five, (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide 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 (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide?
The CAS number of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide is 956684-13-2.
What is the molecular formula of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide?
The molecular formula of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide is C20H16N4OS.
What is the molecular weight of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide?
The molecular weight of (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide is 360.10 g/mol.
Where can I buy (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide?
You can request a quote for (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-cyano-3-[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.