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Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate
TL;DR: Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate (CAS 374608-34-1) is a chemical compound with molecular formula C22H25NO4 and molecular weight 367.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate
Also Known As: ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate, ethyl 5-(acetyloxy)-1-butyl-2-methyl-1H-benzo[g]indole-3-carboxylate, 1-butyl-3-(ethoxycarbonyl)-2-methylbenzo[g]indol-5-yl acetate, ethyl 5-acetoxy-1-butyl-2-methyl-1H-benzo[g]indole-3-carboxylate
| Molecular Formula | C22H25NO4 |
|---|---|
| Molecular Weight | 367.18 g/mol |
| LogP | 5.00502 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.17834 |
| Heavy Atoms | 27 |
| Complexity | 1016.2379 |
Chemical Identifiers
| CAS Number | 374608-34-1 |
|---|---|
| SMILES | CCCCN1C(=C(C2=C1C3=CC=CC=C3C(=C2)OC(=O)C)C(=O)OCC)C |
Product Overview
Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate (CAS 374608-34-1), with molecular formula C22H25NO4 and molecular weight 367.18 g/mol. IUPAC: ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate.
Chemical Property Profile of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate
Property Insights of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate
The XLogP value of 5.00502 indicates that Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.53 Ų, Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate 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 Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate?
The CAS number of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate is 374608-34-1.
What is the molecular formula of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate?
The molecular formula of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate is C22H25NO4.
What is the molecular weight of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate?
The molecular weight of Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate is 367.18 g/mol.
Where can I buy Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate?
You can request a quote for Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-acetyloxy-1-butyl-2-methylbenzo[g]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.