N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide
TL;DR: N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide (CAS 532970-61-9) is a chemical compound with molecular formula C25H24N2OS and molecular weight 400.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3-benzylsulfanylindol-1-yl)ethyl]-4-methylbenzamide
Also Known As: N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide, N-[2-(3-benzylsulfanylindol-1-yl)ethyl]-4-methylbenzamide, N-{2-[3-(benzylsulfanyl)-1H-indol-1-yl]ethyl}-4-methylbenzamide, F0554-0118
| Molecular Formula | C25H24N2OS |
|---|---|
| Molecular Weight | 400.16 g/mol |
| LogP | 5.67202 |
| Topological Polar Surface Area | 34.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 400.16095 |
| Heavy Atoms | 29 |
| Complexity | 1100.8485 |
Chemical Identifiers
| CAS Number | 532970-61-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC4=CC=CC=C4 |
Product Overview
N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide (CAS 532970-61-9), with molecular formula C25H24N2OS and molecular weight 400.16 g/mol. IUPAC: N-[2-(3-benzylsulfanylindol-1-yl)ethyl]-4-methylbenzamide.
Chemical Property Profile of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide
Property Insights of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide
The XLogP value of 5.67202 indicates that N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.03 Ų, N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide?
The CAS number of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide is 532970-61-9.
What is the molecular formula of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide?
The molecular formula of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide is C25H24N2OS.
What is the molecular weight of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide?
The molecular weight of N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide is 400.16 g/mol.
Where can I buy N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide?
You can request a quote for N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(3-(benzylthio)-1H-indol-1-yl)ethyl)-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.