AC1MIJVX
N-[2-(benzimidazol-1-yl)ethyl]-2-methyl-3-phenothiazin-10-ylpropan-1-amine;oxalic acid
Also Known As: 10-(3-((2-(1-Benzimidazolyl)ethyl)amino)-2-methylpropyl)phenothiazine oxalate|Phenothiazine, 10-(3-((2-(1-benzimidazolyl)ethyl)amino)2-methylpropyl)-, oxalate|N-[2-(benzimidazol-1-yl)ethyl]-2-methyl-3-phenothiazin-10-ylpropan-1-amine; oxalic acid|10H-Phenothiazine-10-propanamine, N-(2-(1H-benzimidazol-1-yl)ethyl)-beta-methyl-, ethanedioate (1:1)|Oxalic acid--N-[2-(1H-1,3-benzimidazol-1-yl)ethyl]-2-methyl-3-(10H-phenothiazin-10-yl)propan-1-amine (1/1)|Oxalic acid--N-[2-(1H-benzimidazol-1-yl)ethyl]-2-methyl-3-(10H-phenothiazin-10-yl)propan-1-amine (1/1)
| Molecular Formula | C27H28N4O4S |
|---|---|
| Molecular Weight | 504.18314 g/mol |
| LogP | 4.7205 |
| Topological Polar Surface Area | 107.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.18314 |
| Monoisotopic Mass | 504.18314 |
| Heavy Atoms | 36 |
| Complexity | 1298.8784 |
Chemical Identifiers
| CAS Number | 61981-83-7 |
|---|---|
| SMILES | CC(CNCCN1C=NC2=CC=CC=C21)CN3C4=CC=CC=C4SC5=CC=CC=C53.C(=O)(C(=O)O)O |
Product Overview
AC1MIJVX (CAS 61981-83-7), with molecular formula C27H28N4O4S and molecular weight 504.18314 g/mol. IUPAC: N-[2-(benzimidazol-1-yl)ethyl]-2-methyl-3-phenothiazin-10-ylpropan-1-amine;oxalic acid.