3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)
TL;DR: 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) (CAS 70403-61-1) is a chemical compound with molecular formula C17H22N2O4 and molecular weight 318.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-(2-methylindolizin-3-yl)ethyl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: 3-(2-Dimethylaminoethyl)-2-methylindolizine maleate, N,N,2-Trimethyl-3-indolizineethanamine (Z)-2-butenedioate, 3-INDOLIZINEETHANAMINE, N,N,2-TRIMETHYL-, (Z)-2-BUTENEDIOATE (1:1), dimethyl-[2-(2-methylindolizin-3-yl)ethyl]azanium; (Z)-4-hydroxy-4-oxobut-2-enoate, RefChem:1068054
| Molecular Formula | C17H22N2O4 |
|---|---|
| Molecular Weight | 318.16 g/mol |
| LogP | -0.68818 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.15796 |
| Heavy Atoms | 23 |
| Complexity | 685.68134 |
Chemical Identifiers
| CAS Number | 70403-61-1 |
|---|---|
| SMILES | CC1=C(N2C=CC=CC2=C1)CC[NH+](C)C.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) (CAS 70403-61-1), with molecular formula C17H22N2O4 and molecular weight 318.16 g/mol. IUPAC: dimethyl-[2-(2-methylindolizin-3-yl)ethyl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)
Property Insights of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)
The XLogP value of -0.68818 indicates that 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1). Following Lipinski's Rule of Five, 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) has 2 hydrogen bond donor(s) and 3 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 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)?
The CAS number of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) is 70403-61-1.
What is the molecular formula of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)?
The molecular formula of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) is C17H22N2O4.
What is the molecular weight of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)?
The molecular weight of 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) is 318.16 g/mol.
Where can I buy 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)?
You can request a quote for 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Indolizineethanamine, N,N,2-trimethyl-, (Z)-2-butenedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.