1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole
TL;DR: 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole (CAS 352553-40-3) is a chemical compound with molecular formula C25H32N2O4 and molecular weight 424.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,2-dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole
Also Known As: 1-(2,2-dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole, 1-(2,2-dibutoxyethyl)-5-nitro-2-methyl-3-phenyl-1H-indole, AH-262/34334047, 1-(2,2-dibutoxyethyl)-2-methyl-5-nitro-3-phenyl-1H-indole
| Molecular Formula | C25H32N2O4 |
|---|---|
| Molecular Weight | 424.24 g/mol |
| LogP | 6.48442 |
| Topological Polar Surface Area | 66.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 424.2362 |
| Heavy Atoms | 31 |
| Complexity | 987.6747 |
Chemical Identifiers
| CAS Number | 352553-40-3 |
|---|---|
| SMILES | CCCCOC(CN1C(=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3)C)OCCCC |
Product Overview
1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole (CAS 352553-40-3), with molecular formula C25H32N2O4 and molecular weight 424.24 g/mol. IUPAC: 1-(2,2-dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole.
Chemical Property Profile of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole
Property Insights of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole
The XLogP value of 6.48442 indicates that 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole. Following Lipinski's Rule of Five, 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole?
The CAS number of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole is 352553-40-3.
What is the molecular formula of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole?
The molecular formula of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole is C25H32N2O4.
What is the molecular weight of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole?
The molecular weight of 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole is 424.24 g/mol.
Where can I buy 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole?
You can request a quote for 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,2-Dibutoxyethyl)-2-methyl-5-nitro-3-phenylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.