RefChem:1064467
TL;DR: RefChem:1064467 (CAS 107761-27-3) is a chemical compound with molecular formula C19H17BrN2O3S and molecular weight 432.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-[(4-bromophenyl)sulfanylmethyl]-5-ethoxy-4-hydroxyphenyl]-2-cyanoprop-2-enamide
Also Known As: 3-(3-(((4-(Bromophenyl)thio)methyl)-5-ethoxy-4-hydroxyphenyl)phenyl)-2-cyano-2-propenamide, 2-Propenamide, 3-(3-(((4-bromophenyl)thio)methyl)-5-ethoxy-4-hydroxyphenyl)phenyl)-2-cyano-, (E)-3-[3-[(4-bromophenyl)sulfanylmethyl]-5-ethoxy-4-hydroxyphenyl]-2-cyanoprop-2-enamide, RefChem:1064467
| Molecular Formula | C19H17BrN2O3S |
|---|---|
| Molecular Weight | 432.01 g/mol |
| LogP | 4.23798 |
| Topological Polar Surface Area | 96.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.01434 |
| Heavy Atoms | 26 |
| Complexity | 873.5884 |
Chemical Identifiers
| CAS Number | 107761-27-3 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1O)CSC2=CC=C(C=C2)Br)/C=C(\C#N)/C(=O)N |
Product Overview
RefChem:1064467 (CAS 107761-27-3), with molecular formula C19H17BrN2O3S and molecular weight 432.01 g/mol. IUPAC: (E)-3-[3-[(4-bromophenyl)sulfanylmethyl]-5-ethoxy-4-hydroxyphenyl]-2-cyanoprop-2-enamide.
Chemical Property Profile of RefChem:1064467
Property Insights of RefChem:1064467
The XLogP value of 4.23798 indicates that RefChem:1064467 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.34 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1064467. Following Lipinski's Rule of Five, RefChem:1064467 has 2 hydrogen bond donor(s) and 5 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 RefChem:1064467?
The CAS number of RefChem:1064467 is 107761-27-3.
What is the molecular formula of RefChem:1064467?
The molecular formula of RefChem:1064467 is C19H17BrN2O3S.
What is the molecular weight of RefChem:1064467?
The molecular weight of RefChem:1064467 is 432.01 g/mol.
Where can I buy RefChem:1064467?
You can request a quote for RefChem:1064467 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1064467?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1064467 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.