![(2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile structure](/static/products/957/957488-06-1.png)
(2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile
TL;DR: (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile (CAS 957488-06-1) is a chemical compound with molecular formula C20H16N4O5S and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enenitrile
Also Known As: (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile, (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enenitrile, 3-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-2-(phenylsulfonyl)acrylonitrile, (2Z)-2-(Benzenesulfonyl)-3-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}prop-2-enenitrile, (2Z)-3-{4-methoxy-3-[(4-nitropyrazolyl)methyl]phenyl}-2-(phenylsulfonyl)prop-2 -enenitrile
| Molecular Formula | C20H16N4O5S |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 3.18658 |
| Topological Polar Surface Area | 128.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.08414 |
| Heavy Atoms | 30 |
| Complexity | 1257.849 |
Chemical Identifiers
| CAS Number | 957488-06-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C(/C#N)\S(=O)(=O)C2=CC=CC=C2)CN3C=C(C=N3)[N+](=O)[O-] |
Product Overview
(2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile (CAS 957488-06-1), with molecular formula C20H16N4O5S and molecular weight 424.08 g/mol. IUPAC: (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enenitrile.
Chemical Property Profile of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile
Property Insights of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile
The XLogP value of 3.18658 indicates that (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile. Following Lipinski's Rule of Five, (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile has 0 hydrogen bond donor(s) and 7 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 (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile?
The CAS number of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile is 957488-06-1.
What is the molecular formula of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile?
The molecular formula of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile is C20H16N4O5S.
What is the molecular weight of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile?
The molecular weight of (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile is 424.08 g/mol.
Where can I buy (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile?
You can request a quote for (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-3-[4-Methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl]-2-(phenylsulfonyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.