10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate
TL;DR: 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate (CAS 61981-85-9) is a chemical compound with molecular formula C28H30N4O4S and molecular weight 518.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-phenothiazin-10-ylpropan-1-amine;oxalic acid
Also Known As: 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate, Phenothiazine, 10-(3-((2-(2-methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)-, oxalate, 2-methyl-N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-phenothiazin-10-ylpropan-1-amine,oxalic acid, 2-methyl-N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-phenothiazin-10-ylpropan-1-amine; oxalic acid, Oxalic acid--2-methyl-N-[2-(2-methyl-1H-1,3-benzimidazol-1-yl)ethyl]-3-(10H-phenothiazin-10-yl)propan-1-amine (1/1)
| Molecular Formula | C28H30N4O4S |
|---|---|
| Molecular Weight | 518.20 g/mol |
| LogP | 5.02892 |
| Topological Polar Surface Area | 107.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.1988 |
| Heavy Atoms | 37 |
| Complexity | 1346.4734 |
Chemical Identifiers
| CAS Number | 61981-85-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N1CCNCC(C)CN3C4=CC=CC=C4SC5=CC=CC=C53.C(=O)(C(=O)O)O |
Product Overview
10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate (CAS 61981-85-9), with molecular formula C28H30N4O4S and molecular weight 518.20 g/mol. IUPAC: 2-methyl-N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-phenothiazin-10-ylpropan-1-amine;oxalic acid.
Chemical Property Profile of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate
Property Insights of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate
The XLogP value of 5.02892 indicates that 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate. Following Lipinski's Rule of Five, 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate has 3 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 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate?
The CAS number of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate is 61981-85-9.
What is the molecular formula of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate?
The molecular formula of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate is C28H30N4O4S.
What is the molecular weight of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate?
The molecular weight of 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate is 518.20 g/mol.
Where can I buy 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate?
You can request a quote for 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate?
Yes, KEHONG BIO provides custom synthesis services for 10-(3-((2-(2-Methyl-1-benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.