F0554-0095
TL;DR: F0554-0095 (CAS 532970-37-9) is a chemical compound with molecular formula C28H29N3O2S and molecular weight 471.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2-methylbenzamide
Also Known As: F0554-0095, N-(2-(3-((2-((3,5-dimethylphenyl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-2-methylbenzamide, N-{2-[3-({[(3,5-dimethylphenyl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}-2-methylbenzamide, N-[2-[3-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2-methylbenzamide, N-[2-[3-[(3,5-dimethylphenyl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]-2-methyl-benzamide
| Molecular Formula | C28H29N3O2S |
|---|---|
| Molecular Weight | 471.20 g/mol |
| LogP | 5.72736 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 471.19806 |
| Heavy Atoms | 34 |
| Complexity | 1322.4963 |
Chemical Identifiers
| CAS Number | 532970-37-9 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC(=CC(=C4)C)C |
Product Overview
F0554-0095 (CAS 532970-37-9), with molecular formula C28H29N3O2S and molecular weight 471.20 g/mol. IUPAC: N-[2-[3-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-2-methylbenzamide.
Chemical Property Profile of F0554-0095
Property Insights of F0554-0095
The XLogP value of 5.72736 indicates that F0554-0095 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 F0554-0095. Following Lipinski's Rule of Five, F0554-0095 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 F0554-0095?
The CAS number of F0554-0095 is 532970-37-9.
What is the molecular formula of F0554-0095?
The molecular formula of F0554-0095 is C28H29N3O2S.
What is the molecular weight of F0554-0095?
The molecular weight of F0554-0095 is 471.20 g/mol.
Where can I buy F0554-0095?
You can request a quote for F0554-0095 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0554-0095?
Yes, KEHONG BIO provides custom synthesis services for F0554-0095 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.