Bionet1_002867
TL;DR: Bionet1_002867 (CAS 313687-66-0) is a chemical compound with molecular formula C21H18N2O3S and molecular weight 378.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: Bionet1_002867, 3-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acrylonitrile, 3-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C21H18N2O3S |
|---|---|
| Molecular Weight | 378.10 g/mol |
| LogP | 4.90008 |
| Topological Polar Surface Area | 64.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.10382 |
| Heavy Atoms | 27 |
| Complexity | 1001.01135 |
Chemical Identifiers
| CAS Number | 313687-66-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CSC(=N2)C(=CC3=CC(=C(C=C3)OC)OC)C#N |
Product Overview
Bionet1_002867 (CAS 313687-66-0), with molecular formula C21H18N2O3S and molecular weight 378.10 g/mol. IUPAC: 3-(3,4-dimethoxyphenyl)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of Bionet1_002867
Property Insights of Bionet1_002867
The XLogP value of 4.90008 indicates that Bionet1_002867 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002867. Following Lipinski's Rule of Five, Bionet1_002867 has 0 hydrogen bond donor(s) and 6 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 Bionet1_002867?
The CAS number of Bionet1_002867 is 313687-66-0.
What is the molecular formula of Bionet1_002867?
The molecular formula of Bionet1_002867 is C21H18N2O3S.
What is the molecular weight of Bionet1_002867?
The molecular weight of Bionet1_002867 is 378.10 g/mol.
Where can I buy Bionet1_002867?
You can request a quote for Bionet1_002867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002867?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.