(Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile
TL;DR: (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile (CAS 1009186-77-9) is a chemical compound with molecular formula C25H24N4O2S and molecular weight 444.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-[3-(4-ethylsulfanylphenyl)-1-phenylpyrazol-4-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile
Also Known As: (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile, (Z)-3-[3-(4-ethylsulfanylphenyl)-1-phenylpyrazol-4-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile, 3-[3-(4-ethylsulfanylphenyl)-1-phenyl-pyrazol-4-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile
| Molecular Formula | C25H24N4O2S |
|---|---|
| Molecular Weight | 444.16 g/mol |
| LogP | 4.41708 |
| Topological Polar Surface Area | 71.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.162 |
| Heavy Atoms | 32 |
| Complexity | 1140.935 |
Chemical Identifiers
| CAS Number | 1009186-77-9 |
|---|---|
| SMILES | CCSC1=CC=C(C=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)N3CCOCC3)C4=CC=CC=C4 |
Product Overview
(Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile (CAS 1009186-77-9), with molecular formula C25H24N4O2S and molecular weight 444.16 g/mol. IUPAC: (Z)-3-[3-(4-ethylsulfanylphenyl)-1-phenylpyrazol-4-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile.
Chemical Property Profile of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile
Property Insights of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile
The XLogP value of 4.41708 indicates that (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.15 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile. Following Lipinski's Rule of Five, (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile has 0 hydrogen bond donor(s) and 5 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 (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile?
The CAS number of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile is 1009186-77-9.
What is the molecular formula of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile?
The molecular formula of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile is C25H24N4O2S.
What is the molecular weight of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile?
The molecular weight of (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile is 444.16 g/mol.
Where can I buy (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile?
You can request a quote for (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(3-(4-(ethylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(morpholine-4-carbonyl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.