1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole
TL;DR: 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole (CAS 89159-70-6) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole
Also Known As: BIM-0042853.P001, 1-methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole, 5-nitro-1-methyl-3-phenyl-2-(1-pyrrolidinylmethyl)-1H-indole, AH-262/10236013
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 4.3493 |
| Topological Polar Surface Area | 51.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 925.0143 |
Chemical Identifiers
| CAS Number | 89159-70-6 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=C1CN3CCCC3)C4=CC=CC=C4 |
Product Overview
1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole (CAS 89159-70-6), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: 1-methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole.
Chemical Property Profile of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole
Property Insights of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole
The XLogP value of 4.3493 indicates that 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.31 Ų, 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole has 0 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 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole?
The CAS number of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole is 89159-70-6.
What is the molecular formula of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole?
The molecular formula of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole is C20H21N3O2.
What is the molecular weight of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole?
The molecular weight of 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole is 335.16 g/mol.
Where can I buy 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole?
You can request a quote for 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-5-nitro-3-phenyl-2-(pyrrolidin-1-ylmethyl)indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.