3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole
TL;DR: 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole (CAS 35998-05-1) is a chemical compound with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-3-(4-methyl-2-nitropentyl)-1H-indole
Also Known As: 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole, 6-methyl-3-(4-methyl-2-nitropentyl)-1H-indole, AE-473/30364030
| Molecular Formula | C15H20N2O2 |
|---|---|
| Molecular Weight | 260.15 g/mol |
| LogP | 3.71022 |
| Topological Polar Surface Area | 58.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.15247 |
| Heavy Atoms | 19 |
| Complexity | 586.84314 |
Chemical Identifiers
| CAS Number | 35998-05-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=CN2)CC(CC(C)C)[N+](=O)[O-] |
Product Overview
3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole (CAS 35998-05-1), with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol. IUPAC: 6-methyl-3-(4-methyl-2-nitropentyl)-1H-indole.
Chemical Property Profile of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole
Property Insights of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole
The XLogP value of 3.71022 indicates that 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.93 Ų, 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole has 1 hydrogen bond donor(s) and 2 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-{2-nitro-4-methylpentyl}-6-methyl-1H-indole?
The CAS number of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole is 35998-05-1.
What is the molecular formula of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole?
The molecular formula of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole is C15H20N2O2.
What is the molecular weight of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole?
The molecular weight of 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole is 260.15 g/mol.
Where can I buy 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole?
You can request a quote for 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-{2-nitro-4-methylpentyl}-6-methyl-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.