F0554-1025
TL;DR: F0554-1025 (CAS 533867-61-7) is a chemical compound with molecular formula C29H31N3O6S and molecular weight 549.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-3,4-dimethoxybenzamide
Also Known As: F0554-1025, N-{2-[3-({[(2,4-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}-3,4-dimethoxybenzamide, N-(2-(3-((2-((2,4-dimethoxyphenyl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-3,4-dimethoxybenzamide, N-[2-[3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-3,4-dimethoxybenzamide, N-[2-[3-[(2,4-dimethoxyphenyl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]-3,4-dimethoxy-benzamide
| Molecular Formula | C29H31N3O6S |
|---|---|
| Molecular Weight | 549.19 g/mol |
| LogP | 4.8365 |
| Topological Polar Surface Area | 100.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 549.19336 |
| Heavy Atoms | 39 |
| Complexity | 1468.9377 |
Chemical Identifiers
| CAS Number | 533867-61-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC(=C(C=C4)OC)OC)OC |
Product Overview
F0554-1025 (CAS 533867-61-7), with molecular formula C29H31N3O6S and molecular weight 549.19 g/mol. IUPAC: N-[2-[3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-3,4-dimethoxybenzamide.
Chemical Property Profile of F0554-1025
Property Insights of F0554-1025
The XLogP value of 4.8365 indicates that F0554-1025 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.05 Ų falls within the moderate polarity range, balancing permeability and solubility for F0554-1025. Following Lipinski's Rule of Five, F0554-1025 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0554-1025?
The CAS number of F0554-1025 is 533867-61-7.
What is the molecular formula of F0554-1025?
The molecular formula of F0554-1025 is C29H31N3O6S.
What is the molecular weight of F0554-1025?
The molecular weight of F0554-1025 is 549.19 g/mol.
Where can I buy F0554-1025?
You can request a quote for F0554-1025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-1025?
Yes, KEHONG BIO provides custom synthesis services for F0554-1025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.