Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)
TL;DR: Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) (CAS 131028-60-9) is a chemical compound with molecular formula C18H25N3O5S and molecular weight 395.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[4-[(5-methyl-1H-imidazol-4-yl)methylsulfanylmethyl]phenoxy]ethanamine;oxalic acid
Also Known As: Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2), N,N-dimethyl-2-[4-[(5-methyl-1H-imidazol-4-yl)methylsulfanylmethyl]phenoxy]ethanamine; Oxalic Acid, Oxalic acid--N,N-dimethyl-2-[4-({[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}methyl)phenoxy]ethan-1-amine (1/1), RefChem:339893
| Molecular Formula | C18H25N3O5S |
|---|---|
| Molecular Weight | 395.15 g/mol |
| LogP | 2.24752 |
| Topological Polar Surface Area | 115.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 395.1515 |
| Heavy Atoms | 27 |
| Complexity | 704.0421 |
Chemical Identifiers
| CAS Number | 131028-60-9 |
|---|---|
| SMILES | CC1=C(N=CN1)CSCC2=CC=C(C=C2)OCCN(C)C.C(=O)(C(=O)O)O |
Product Overview
Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) (CAS 131028-60-9), with molecular formula C18H25N3O5S and molecular weight 395.15 g/mol. IUPAC: N,N-dimethyl-2-[4-[(5-methyl-1H-imidazol-4-yl)methylsulfanylmethyl]phenoxy]ethanamine;oxalic acid.
Chemical Property Profile of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)
Property Insights of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)
The XLogP value of 2.24752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2). The TPSA of 115.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2). Following Lipinski's Rule of Five, Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) has 3 hydrogen bond donor(s) and 6 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 Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)?
The CAS number of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) is 131028-60-9.
What is the molecular formula of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)?
The molecular formula of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) is C18H25N3O5S.
What is the molecular weight of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)?
The molecular weight of Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) is 395.15 g/mol.
Where can I buy Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)?
You can request a quote for Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Ethanamine, N,N-dimethyl-2-(4-((((5-methyl-1H-imidazol-4-yl)methyl)thio)methyl)phenoxy)-, ethanedioate (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.