1-Acetyl-5-methoxy-1H-indole
TL;DR: 1-Acetyl-5-methoxy-1H-indole (CAS 58248-07-0) is a chemical compound with molecular formula C32H40N4O8 and molecular weight 608.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoic acid);piperazine
Also Known As: 1-Acetyl-5-methoxy-1H-indole, 1,3-Dioxo-alpha-isobutyl-2H-isoindoline-2-acetic acid piperazine (salt), 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoic acid,piperazine, 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoic acid; piperazine, 2H-Isoindole-2-acetic acid, 1,3-dihydro-alpha-(2-methylpropyl)-1,3-dioxo-, compd. with piperazine (2:1)
| Molecular Formula | C32H40N4O8 |
|---|---|
| Molecular Weight | 608.28 g/mol |
| LogP | 2.743 |
| Topological Polar Surface Area | 173.42 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 608.2846 |
| Heavy Atoms | 44 |
| Complexity | 1221.1173 |
Chemical Identifiers
| CAS Number | 58248-07-0 |
|---|---|
| SMILES | CC(C)CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O.CC(C)CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O.C1CNCCN1 |
Product Overview
1-Acetyl-5-methoxy-1H-indole (CAS 58248-07-0), with molecular formula C32H40N4O8 and molecular weight 608.28 g/mol. IUPAC: bis(2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoic acid);piperazine.
Chemical Property Profile of 1-Acetyl-5-methoxy-1H-indole
Property Insights of 1-Acetyl-5-methoxy-1H-indole
The XLogP value of 2.743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetyl-5-methoxy-1H-indole. The TPSA of 173.42 Ų indicates high polarity, suggesting 1-Acetyl-5-methoxy-1H-indole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Acetyl-5-methoxy-1H-indole has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Acetyl-5-methoxy-1H-indole?
The CAS number of 1-Acetyl-5-methoxy-1H-indole is 58248-07-0.
What is the molecular formula of 1-Acetyl-5-methoxy-1H-indole?
The molecular formula of 1-Acetyl-5-methoxy-1H-indole is C32H40N4O8.
What is the molecular weight of 1-Acetyl-5-methoxy-1H-indole?
The molecular weight of 1-Acetyl-5-methoxy-1H-indole is 608.28 g/mol.
Where can I buy 1-Acetyl-5-methoxy-1H-indole?
You can request a quote for 1-Acetyl-5-methoxy-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-5-methoxy-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-5-methoxy-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.