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N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide
TL;DR: N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide (CAS 689264-44-6) is a chemical compound with molecular formula C18H17N3O3 and molecular weight 323.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide
Also Known As: N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide, AB01292204-01, N-(2-(2-methyl-1H-indol-1-yl)ethyl)-3-nitrobenzamide, N-[2-(2-methylindol-1-yl)ethyl]-3-nitro-benzamide, F0613-0105
| Molecular Formula | C18H17N3O3 |
|---|---|
| Molecular Weight | 323.13 g/mol |
| LogP | 3.28792 |
| Topological Polar Surface Area | 77.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.12698 |
| Heavy Atoms | 24 |
| Complexity | 914.76794 |
Chemical Identifiers
| CAS Number | 689264-44-6 |
|---|---|
| SMILES | CC1=CC2=CC=CC=C2N1CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide (CAS 689264-44-6), with molecular formula C18H17N3O3 and molecular weight 323.13 g/mol. IUPAC: N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide.
Chemical Property Profile of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide
Property Insights of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide
The XLogP value of 3.28792 indicates that N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.17 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide?
The CAS number of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide is 689264-44-6.
What is the molecular formula of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide?
The molecular formula of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide is C18H17N3O3.
What is the molecular weight of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide?
The molecular weight of N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide is 323.13 g/mol.
Where can I buy N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide?
You can request a quote for N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(2-methylindol-1-yl)ethyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.