AB01334628-02
TL;DR: AB01334628-02 (CAS 327061-72-3) is a chemical compound with molecular formula C22H16F3NO3 and molecular weight 399.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(3,4-dimethoxyphenyl)-3-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-enenitrile
Also Known As: AB01334628-02, (2Z)-2-(3,4-dimethoxyphenyl)-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enenitrile, (Z)-2-(3,4-dimethoxyphenyl)-3-(5-(3-(trifluoromethyl)phenyl)furan-2-yl)acrylonitrile, (Z)-2-(3,4-dimethoxyphenyl)-3-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-enenitrile, (2Z)-2-(3,4-dimethoxyphenyl)-3-{5-[3-(trifluoromethyl)phenyl](2-furyl)}prop-2- enenitrile
| Molecular Formula | C22H16F3NO3 |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 6.04678 |
| Topological Polar Surface Area | 55.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.10822 |
| Heavy Atoms | 29 |
| Complexity | 1091.1674 |
Chemical Identifiers
| CAS Number | 327061-72-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=C/C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)/C#N)OC |
Product Overview
AB01334628-02 (CAS 327061-72-3), with molecular formula C22H16F3NO3 and molecular weight 399.11 g/mol. IUPAC: (Z)-2-(3,4-dimethoxyphenyl)-3-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-enenitrile.
Chemical Property Profile of AB01334628-02
Property Insights of AB01334628-02
The XLogP value of 6.04678 indicates that AB01334628-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.39 Ų, AB01334628-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01334628-02 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB01334628-02?
The CAS number of AB01334628-02 is 327061-72-3.
What is the molecular formula of AB01334628-02?
The molecular formula of AB01334628-02 is C22H16F3NO3.
What is the molecular weight of AB01334628-02?
The molecular weight of AB01334628-02 is 399.11 g/mol.
Where can I buy AB01334628-02?
You can request a quote for AB01334628-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01334628-02?
Yes, KEHONG BIO provides custom synthesis services for AB01334628-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.