F0617-0053
TL;DR: F0617-0053 (CAS 851714-40-4) is a chemical compound with molecular formula C25H19F4N3O2S and molecular weight 501.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2,6-difluorobenzamide
Also Known As: F0617-0053, N-(2-(3-((2-((2,4-difluorophenyl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-2,6-difluorobenzamide, N-{2-[3-({[(2,4-difluorophenyl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}-2,6-difluorobenzamide, N-[2-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2,6-difluorobenzamide, N-[2-[3-[(2,4-difluorophenyl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]-2,6-difluoro-benzamide
| Molecular Formula | C25H19F4N3O2S |
|---|---|
| Molecular Weight | 501.11 g/mol |
| LogP | 5.3585 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 501.1134 |
| Heavy Atoms | 35 |
| Complexity | 1386.7434 |
Chemical Identifiers
| CAS Number | 851714-40-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=C(C=CC=C3F)F)SCC(=O)NC4=C(C=C(C=C4)F)F |
Product Overview
F0617-0053 (CAS 851714-40-4), with molecular formula C25H19F4N3O2S and molecular weight 501.11 g/mol. IUPAC: N-[2-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2,6-difluorobenzamide.
Chemical Property Profile of F0617-0053
Property Insights of F0617-0053
The XLogP value of 5.3585 indicates that F0617-0053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F0617-0053. Following Lipinski's Rule of Five, F0617-0053 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0617-0053?
The CAS number of F0617-0053 is 851714-40-4.
What is the molecular formula of F0617-0053?
The molecular formula of F0617-0053 is C25H19F4N3O2S.
What is the molecular weight of F0617-0053?
The molecular weight of F0617-0053 is 501.11 g/mol.
Where can I buy F0617-0053?
You can request a quote for F0617-0053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0617-0053?
Yes, KEHONG BIO provides custom synthesis services for F0617-0053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.