(Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide
TL;DR: (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide (CAS 1008880-38-3) is a chemical compound with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-[3-(4-butylsulfanylphenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide
Also Known As: (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide, (Z)-3-[3-(4-butylsulfanylphenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide, 3-[3-(4-butylsulfanylphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide
| Molecular Formula | C28H30N4O2S |
|---|---|
| Molecular Weight | 486.21 g/mol |
| LogP | 5.63368 |
| Topological Polar Surface Area | 79.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 486.20895 |
| Heavy Atoms | 35 |
| Complexity | 1189.9453 |
Chemical Identifiers
| CAS Number | 1008880-38-3 |
|---|---|
| SMILES | CCCCSC1=CC=C(C=C1)C2=NN(C=C2/C=C(/C#N)\C(=O)NCC3CCCO3)C4=CC=CC=C4 |
Product Overview
(Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide (CAS 1008880-38-3), with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol. IUPAC: (Z)-3-[3-(4-butylsulfanylphenyl)-1-phenylpyrazol-4-yl]-2-cyano-N-(oxolan-2-ylmethyl)prop-2-enamide.
Chemical Property Profile of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide
Property Insights of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide
The XLogP value of 5.63368 indicates that (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.94 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide. Following Lipinski's Rule of Five, (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide 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 (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
The CAS number of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide is 1008880-38-3.
What is the molecular formula of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
The molecular formula of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide is C28H30N4O2S.
What is the molecular weight of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
The molecular weight of (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide is 486.21 g/mol.
Where can I buy (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
You can request a quote for (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide 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-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(3-(4-(butylthio)phenyl)-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-((tetrahydrofuran-2-yl)methyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.