(Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile
TL;DR: (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile (CAS 1003987-94-7) is a chemical compound with molecular formula C27H27N5O5S and molecular weight 533.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(morpholine-4-carbonyl)-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]prop-2-enenitrile
Also Known As: (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile, (Z)-2-(morpholine-4-carbonyl)-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]prop-2-enenitrile
| Molecular Formula | C27H27N5O5S |
|---|---|
| Molecular Weight | 533.17 g/mol |
| LogP | 2.32598 |
| Topological Polar Surface Area | 117.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 533.1733 |
| Heavy Atoms | 38 |
| Complexity | 1481.4961 |
Chemical Identifiers
| CAS Number | 1003987-94-7 |
|---|---|
| SMILES | C1COCCN1C(=O)/C(=C\C2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5)/C#N |
Product Overview
(Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile (CAS 1003987-94-7), with molecular formula C27H27N5O5S and molecular weight 533.17 g/mol. IUPAC: (Z)-2-(morpholine-4-carbonyl)-3-[3-(3-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]prop-2-enenitrile.
Chemical Property Profile of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile
Property Insights of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile
The XLogP value of 2.32598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile. The TPSA of 117.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile. Following Lipinski's Rule of Five, (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile has 0 hydrogen bond donor(s) and 7 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-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile?
The CAS number of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile is 1003987-94-7.
What is the molecular formula of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile?
The molecular formula of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile is C27H27N5O5S.
What is the molecular weight of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile?
The molecular weight of (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile is 533.17 g/mol.
Where can I buy (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile?
You can request a quote for (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-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-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(morpholine-4-carbonyl)-3-(3-(3-(morpholinosulfonyl)phenyl)-1-phenyl-1H-pyrazol-4-yl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.