Dimethyl 2,3-di(1h-indol-3-yl)butanedioate
TL;DR: Dimethyl 2,3-di(1h-indol-3-yl)butanedioate (CAS 86695-75-2) is a chemical compound with molecular formula C22H20N2O4 and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2,3-bis(1H-indol-3-yl)butanedioate
Also Known As: dimethyl 2,3-di(1h-indol-3-yl)butanedioate, dimethyl 2,3-bis(1H-indol-3-yl)butanedioate, J1.434.210I, 1,4-dimethyl 2,3-bis(1H-indol-3-yl)butanedioate, 2,3-Bis(1H-indole-3-yl)succinic acid dimethyl ester
| Molecular Formula | C22H20N2O4 |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.1423 |
| Heavy Atoms | 28 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 86695-75-2 |
|---|---|
| SMILES | COC(=O)C(C1=CNC2=CC=CC=C21)C(C3=CNC4=CC=CC=C43)C(=O)OC |
| InChIKey | PKAROQQDLLELOE-UHFFFAOYSA-N |
Product Overview
Dimethyl 2,3-di(1h-indol-3-yl)butanedioate (CAS 86695-75-2), with molecular formula C22H20N2O4 and molecular weight 376.14 g/mol. IUPAC: dimethyl 2,3-bis(1H-indol-3-yl)butanedioate.
Chemical Property Profile of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate
Property Insights of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate
The XLogP value of 3.5 indicates that Dimethyl 2,3-di(1h-indol-3-yl)butanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2,3-di(1h-indol-3-yl)butanedioate. Following Lipinski's Rule of Five, Dimethyl 2,3-di(1h-indol-3-yl)butanedioate has 2 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 Dimethyl 2,3-di(1h-indol-3-yl)butanedioate?
The CAS number of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate is 86695-75-2.
What is the molecular formula of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate?
The molecular formula of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate is C22H20N2O4.
What is the molecular weight of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate?
The molecular weight of Dimethyl 2,3-di(1h-indol-3-yl)butanedioate is 376.14 g/mol.
Where can I buy Dimethyl 2,3-di(1h-indol-3-yl)butanedioate?
You can request a quote for Dimethyl 2,3-di(1h-indol-3-yl)butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2,3-di(1h-indol-3-yl)butanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2,3-di(1h-indol-3-yl)butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.