1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)
TL;DR: 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) (CAS 98836-51-2) is a chemical compound with molecular formula C36H52N6O4 and molecular weight 632.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butanedioic acid;bis(N,N-dimethyl-2-(2-methylimidazol-1-yl)-1-phenylbutan-1-amine)
Also Known As: 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1), 1-((2-Phenyl 2-ethyl) 2-N,N-dimethylaminoethyl)-2-methylimidazole hemimaleate [French], 1-((2-Phenyl 2-ethyl) 2-N,N-dimethylaminoethyl)-2-methylimidazole hemimaleate, Butanedioic acid--N,N-dimethyl-2-(2-methyl-1H-imidazol-1-yl)-1-phenylbutan-1-amine (1/2), butanedioic acid; N,N-dimethyl-2-(2-methylimidazol-1-yl)-1-phenylbutan-1-amine
| Molecular Formula | C36H52N6O4 |
|---|---|
| Molecular Weight | 632.40 g/mol |
| LogP | 6.82684 |
| Topological Polar Surface Area | 116.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 632.405 |
| Heavy Atoms | 46 |
| Complexity | 1325.2281 |
Chemical Identifiers
| CAS Number | 98836-51-2 |
|---|---|
| SMILES | CCC(C(C1=CC=CC=C1)N(C)C)N2C=CN=C2C.CCC(C(C1=CC=CC=C1)N(C)C)N2C=CN=C2C.C(CC(=O)O)C(=O)O |
Product Overview
1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) (CAS 98836-51-2), with molecular formula C36H52N6O4 and molecular weight 632.40 g/mol. IUPAC: butanedioic acid;bis(N,N-dimethyl-2-(2-methylimidazol-1-yl)-1-phenylbutan-1-amine).
Chemical Property Profile of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)
Property Insights of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)
The XLogP value of 6.82684 indicates that 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1). Following Lipinski's Rule of Five, 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) 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 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)?
The CAS number of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) is 98836-51-2.
What is the molecular formula of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)?
The molecular formula of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) is C36H52N6O4.
What is the molecular weight of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)?
The molecular weight of 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) is 632.40 g/mol.
Where can I buy 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)?
You can request a quote for 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-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-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-1-ethanamine, alpha-ethyl-alpha-phenyl-N,N,2-trimethyl-, (Z)-2-butenedioate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.