![Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate structure](/static/products/7095/70959-90-9.webp)
Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
TL;DR: Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate (CAS 70959-90-9) is a chemical compound with molecular formula C22H17NO4 and molecular weight 359.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
Also Known As: J1.808.706E, ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate, ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylat, ethyl 2-methyl-4,9-dioxo-1-phenyl-benzo[f]indole-3-carboxylate, 1-Phenyl-2-methyl-4,9-dioxo-1H-benzo[f]indole-3-carboxylic acid ethyl ester
| Molecular Formula | C22H17NO4 |
|---|---|
| Molecular Weight | 359.12 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 65.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.11575 |
| Heavy Atoms | 27 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 70959-90-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C |
| InChIKey | HELAGDGXAKCYPU-UHFFFAOYSA-N |
Product Overview
Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate (CAS 70959-90-9), with molecular formula C22H17NO4 and molecular weight 359.12 g/mol. IUPAC: ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate.
Chemical Property Profile of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
Property Insights of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate
The XLogP value of 4.2 indicates that Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate has 0 hydrogen bond donor(s) and 4 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 Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate?
The CAS number of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate is 70959-90-9.
What is the molecular formula of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate?
The molecular formula of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate is C22H17NO4.
What is the molecular weight of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate?
The molecular weight of Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate is 359.12 g/mol.
Where can I buy Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate?
You can request a quote for Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]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 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-4,9-dioxo-1-phenylbenzo[f]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.