F0554-0081
TL;DR: F0554-0081 (CAS 532970-23-3) is a chemical compound with molecular formula C27H27N3O2S and molecular weight 457.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[2-[3-[2-(4-methylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide
Also Known As: F0554-0081, 2-methyl-N-(2-(3-((2-oxo-2-(p-tolylamino)ethyl)thio)-1H-indol-1-yl)ethyl)benzamide, 2-methyl-N-[2-[3-[2-(4-methylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide, 2-methyl-N-{2-[3-({[(4-methylphenyl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}benzamide, 2-methyl-N-[2-[3-[(4-methylphenyl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]benzamide
| Molecular Formula | C27H27N3O2S |
|---|---|
| Molecular Weight | 457.18 g/mol |
| LogP | 5.41894 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 457.1824 |
| Heavy Atoms | 33 |
| Complexity | 1278.276 |
Chemical Identifiers
| CAS Number | 532970-23-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CC=C4C |
Product Overview
F0554-0081 (CAS 532970-23-3), with molecular formula C27H27N3O2S and molecular weight 457.18 g/mol. IUPAC: 2-methyl-N-[2-[3-[2-(4-methylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide.
Chemical Property Profile of F0554-0081
Property Insights of F0554-0081
The XLogP value of 5.41894 indicates that F0554-0081 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 F0554-0081. Following Lipinski's Rule of Five, F0554-0081 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 F0554-0081?
The CAS number of F0554-0081 is 532970-23-3.
What is the molecular formula of F0554-0081?
The molecular formula of F0554-0081 is C27H27N3O2S.
What is the molecular weight of F0554-0081?
The molecular weight of F0554-0081 is 457.18 g/mol.
Where can I buy F0554-0081?
You can request a quote for F0554-0081 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0081?
Yes, KEHONG BIO provides custom synthesis services for F0554-0081 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.