diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)
TL;DR: diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) (CAS 51903-18-5) is a chemical compound with molecular formula C28H32N2O6 and molecular weight 492.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[4-(3-ethoxycarbonyl-5-hydroxy-2-methylindol-1-yl)butyl]-5-hydroxy-2-methylindole-3-carboxylate
Also Known As: diethyl 1,1'-(butane-1,4-diyl)bis(5-hydroxy-2-methyl-1H-indole-3-carboxylate), diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate), ethyl 1-[4-(3-ethoxycarbonyl-5-hydroxy-2-methylindol-1-yl)butyl]-5-hydroxy-2-methylindole-3-carboxylate, ethyl 1-{4-[3-(ethoxycarbonyl)-5-hydroxy-2-methyl-1H-indol-1-yl]butyl}-5-hydroxy-2-methyl-1H-indole-3-carboxylate
| Molecular Formula | C28H32N2O6 |
|---|---|
| Molecular Weight | 492.23 g/mol |
| LogP | 5.45784 |
| Topological Polar Surface Area | 102.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 492.22604 |
| Heavy Atoms | 36 |
| Complexity | 1336.0338 |
Chemical Identifiers
| CAS Number | 51903-18-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCCCN3C(=C(C4=C3C=CC(=C4)O)C(=O)OCC)C)C |
Product Overview
diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) (CAS 51903-18-5), with molecular formula C28H32N2O6 and molecular weight 492.23 g/mol. IUPAC: ethyl 1-[4-(3-ethoxycarbonyl-5-hydroxy-2-methylindol-1-yl)butyl]-5-hydroxy-2-methylindole-3-carboxylate.
Chemical Property Profile of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)
Property Insights of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)
The XLogP value of 5.45784 indicates that diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.92 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate). Following Lipinski's Rule of Five, diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)?
The CAS number of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) is 51903-18-5.
What is the molecular formula of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)?
The molecular formula of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) is C28H32N2O6.
What is the molecular weight of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)?
The molecular weight of diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) is 492.23 g/mol.
Where can I buy diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)?
You can request a quote for diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-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 diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate)?
Yes, KEHONG BIO provides custom synthesis services for diethyl 1,1'-butane-1,4-diylbis(5-hydroxy-2-methyl-1H-indole-3-carboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.