F0554-0980
TL;DR: F0554-0980 (CAS 533867-22-0) is a chemical compound with molecular formula C26H24ClFN2O3S and molecular weight 498.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-[(2-chloro-6-fluorophenyl)methylsulfanyl]indol-1-yl]ethyl]-3,4-dimethoxybenzamide
Also Known As: F0554-0980, N-(2-(3-((2-chloro-6-fluorobenzyl)thio)-1H-indol-1-yl)ethyl)-3,4-dimethoxybenzamide, N-[2-[3-[(2-chloro-6-fluorophenyl)methylsulfanyl]indol-1-yl]ethyl]-3,4-dimethoxybenzamide, N-[2-(3-{[(2-CHLORO-6-FLUOROPHENYL)METHYL]SULFANYL}-1H-INDOL-1-YL)ETHYL]-3,4-DIMETHOXYBENZAMIDE, N-[2-[3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]indol-1-yl]ethyl]-3,4-dimethoxy-benzamide
| Molecular Formula | C26H24ClFN2O3S |
|---|---|
| Molecular Weight | 498.12 g/mol |
| LogP | 6.1733 |
| Topological Polar Surface Area | 52.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 498.118 |
| Heavy Atoms | 34 |
| Complexity | 1304.6473 |
Chemical Identifiers
| CAS Number | 533867-22-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC4=C(C=CC=C4Cl)F)OC |
Product Overview
F0554-0980 (CAS 533867-22-0), with molecular formula C26H24ClFN2O3S and molecular weight 498.12 g/mol. IUPAC: N-[2-[3-[(2-chloro-6-fluorophenyl)methylsulfanyl]indol-1-yl]ethyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of F0554-0980
Property Insights of F0554-0980
The XLogP value of 6.1733 indicates that F0554-0980 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.49 Ų, F0554-0980 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0554-0980 has 1 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 F0554-0980?
The CAS number of F0554-0980 is 533867-22-0.
What is the molecular formula of F0554-0980?
The molecular formula of F0554-0980 is C26H24ClFN2O3S.
What is the molecular weight of F0554-0980?
The molecular weight of F0554-0980 is 498.12 g/mol.
Where can I buy F0554-0980?
You can request a quote for F0554-0980 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0980?
Yes, KEHONG BIO provides custom synthesis services for F0554-0980 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.