1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)
TL;DR: 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) (CAS 83363-32-0) is a chemical compound with molecular formula C32H40N4O4 and molecular weight 544.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;bis(4-(1-methylpiperidin-3-yl)-1H-indole)
Also Known As: 1h-indole,4-, -2-butenedioate, 4-(1-Methylpiperidin-3-yl)-1H-indole fumarate, 1H-Indole,4- -, -2-butenedioate, 4-(1-Methyl-3-piperidinyl)-1H-indole (E)-2-butenedioate (2:1), 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)
| Molecular Formula | C32H40N4O4 |
|---|---|
| Molecular Weight | 544.30 g/mol |
| LogP | 5.666 |
| Topological Polar Surface Area | 112.66 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 544.30493 |
| Heavy Atoms | 40 |
| Complexity | 1331.0037 |
Chemical Identifiers
| CAS Number | 83363-32-0 |
|---|---|
| SMILES | CN1CCCC(C1)C2=C3C=CNC3=CC=C2.CN1CCCC(C1)C2=C3C=CNC3=CC=C2.C(=C/C(=O)O)\C(=O)O |
Product Overview
1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) (CAS 83363-32-0), with molecular formula C32H40N4O4 and molecular weight 544.30 g/mol. IUPAC: (E)-but-2-enedioic acid;bis(4-(1-methylpiperidin-3-yl)-1H-indole).
Chemical Property Profile of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)
Property Insights of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)
The XLogP value of 5.666 indicates that 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1). Following Lipinski's Rule of Five, 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) has 4 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 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)?
The CAS number of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) is 83363-32-0.
What is the molecular formula of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)?
The molecular formula of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) is C32H40N4O4.
What is the molecular weight of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)?
The molecular weight of 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) is 544.30 g/mol.
Where can I buy 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)?
You can request a quote for 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole, 4-(1-methyl-3-piperidinyl)-, (E)-2-butenedioate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.