1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one
TL;DR: 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one (CAS 5479-59-4) is a chemical compound with molecular formula C26H42N2O3 and molecular weight 430.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-nitro-2,3-dihydroindol-1-yl)octadecan-1-one
Also Known As: 6-nitro-1-stearoylindoline, 1-(6-nitro-2,3-dihydroindol-1-yl)octadecan-1-one, 1-(6-Nitro-2,3-dihydro-1H-indol-1-yl)octadecan-1-one
| Molecular Formula | C26H42N2O3 |
|---|---|
| Molecular Weight | 430.32 g/mol |
| LogP | 7.7454 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 430.31955 |
| Heavy Atoms | 31 |
| Complexity | 674.61597 |
Chemical Identifiers
| CAS Number | 5479-59-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)N1CCC2=C1C=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one (CAS 5479-59-4), with molecular formula C26H42N2O3 and molecular weight 430.32 g/mol. IUPAC: 1-(6-nitro-2,3-dihydroindol-1-yl)octadecan-1-one.
Chemical Property Profile of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one
Property Insights of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one
The XLogP value of 7.7454 indicates that 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one. Following Lipinski's Rule of Five, 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one?
The CAS number of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one is 5479-59-4.
What is the molecular formula of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one?
The molecular formula of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one is C26H42N2O3.
What is the molecular weight of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one?
The molecular weight of 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one is 430.32 g/mol.
Where can I buy 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one?
You can request a quote for 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Nitro-2,3-dihydroindol-1-yl)octadecan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.