![3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol structure](/static/products/3156/315697-65-5.webp)
3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol
TL;DR: 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol (CAS 315697-65-5) is a chemical compound with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol
Also Known As: 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol, 3-[1-(2-methylindol-3-yl)-2-nitroethyl]phenol, 3-[2-nitro-1-(2-methyl-1H-indol-3-yl)ethyl]phenol
| Molecular Formula | C17H16N2O3 |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 3.59052 |
| Topological Polar Surface Area | 79.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.1161 |
| Heavy Atoms | 22 |
| Complexity | 838.79126 |
Chemical Identifiers
| CAS Number | 315697-65-5 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C(C[N+](=O)[O-])C3=CC(=CC=C3)O |
Product Overview
3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol (CAS 315697-65-5), with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol. IUPAC: 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol.
Chemical Property Profile of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol
Property Insights of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol
The XLogP value of 3.59052 indicates that 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol. Following Lipinski's Rule of Five, 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol has 2 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 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol?
The CAS number of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol is 315697-65-5.
What is the molecular formula of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol?
The molecular formula of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol is C17H16N2O3.
What is the molecular weight of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol?
The molecular weight of 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol is 296.12 g/mol.
Where can I buy 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol?
You can request a quote for 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-[1-(2-methyl-1H-indol-3-yl)-2-nitroethyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.