F0653-0618
TL;DR: F0653-0618 (CAS 852167-38-5) is a chemical compound with molecular formula C27H23N5O5S and molecular weight 529.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[[4-(2,5-dimethoxyphenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F0653-0618, N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(2,5-dimethoxyphenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(benzo[d][1,3]dioxol-5-yl)-2-((4-(2,5-dimethoxyphenyl)-5-(1H-indol-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(1,3-benzodioxol-5-yl)-2-[[4-(2,5-dimethoxyphenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(1,3-benzodioxol-5-yl)-2-[[4-(2,5-dimethoxyphenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C27H23N5O5S |
|---|---|
| Molecular Weight | 529.14 g/mol |
| LogP | 4.8923 |
| Topological Polar Surface Area | 112.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 529.14197 |
| Heavy Atoms | 38 |
| Complexity | 1646.45 |
Chemical Identifiers
| CAS Number | 852167-38-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CNC6=CC=CC=C65 |
Product Overview
F0653-0618 (CAS 852167-38-5), with molecular formula C27H23N5O5S and molecular weight 529.14 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[[4-(2,5-dimethoxyphenyl)-5-(1H-indol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of F0653-0618
Property Insights of F0653-0618
The XLogP value of 4.8923 indicates that F0653-0618 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.52 Ų falls within the moderate polarity range, balancing permeability and solubility for F0653-0618. Following Lipinski's Rule of Five, F0653-0618 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0653-0618?
The CAS number of F0653-0618 is 852167-38-5.
What is the molecular formula of F0653-0618?
The molecular formula of F0653-0618 is C27H23N5O5S.
What is the molecular weight of F0653-0618?
The molecular weight of F0653-0618 is 529.14 g/mol.
Where can I buy F0653-0618?
You can request a quote for F0653-0618 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0653-0618?
Yes, KEHONG BIO provides custom synthesis services for F0653-0618 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.