(Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile
TL;DR: (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile (CAS 1003988-56-4) is a chemical compound with molecular formula C28H29N5O4S and molecular weight 531.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(morpholine-4-carbonyl)-3-[1-phenyl-3-(3-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enenitrile
Also Known As: (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile, (Z)-2-(morpholine-4-carbonyl)-3-[1-phenyl-3-(3-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enenitrile
| Molecular Formula | C28H29N5O4S |
|---|---|
| Molecular Weight | 531.19 g/mol |
| LogP | 3.47968 |
| Topological Polar Surface Area | 108.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 531.19403 |
| Heavy Atoms | 38 |
| Complexity | 1478.8818 |
Chemical Identifiers
| CAS Number | 1003988-56-4 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3/C=C(/C#N)\C(=O)N4CCOCC4)C5=CC=CC=C5 |
Product Overview
(Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile (CAS 1003988-56-4), with molecular formula C28H29N5O4S and molecular weight 531.19 g/mol. IUPAC: (Z)-2-(morpholine-4-carbonyl)-3-[1-phenyl-3-(3-piperidin-1-ylsulfonylphenyl)pyrazol-4-yl]prop-2-enenitrile.
Chemical Property Profile of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile
Property Insights of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile
The XLogP value of 3.47968 indicates that (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.53 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile. Following Lipinski's Rule of Five, (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile?
The CAS number of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile is 1003988-56-4.
What is the molecular formula of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile?
The molecular formula of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile is C28H29N5O4S.
What is the molecular weight of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile?
The molecular weight of (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile is 531.19 g/mol.
Where can I buy (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile?
You can request a quote for (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(morpholine-4-carbonyl)-3-(1-phenyl-3-(3-(piperidin-1-ylsulfonyl)phenyl)-1H-pyrazol-4-yl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.