AC1LDFOT
6-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-N-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine
Also Known As: BAS 11416371|NCGC00064635-02|AB00402076-09|6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-N-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine|(4-amino-6-{[4-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)piperazinyl]methyl}(1,3 ,5-triazin-2-yl))(2,4-dimethylphenyl)amine|(4E)-6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-4-[(2,4-dimethylphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-amine|6-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyl)-N2-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine|6-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-N-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine|N-(4-amino-6-{[4-(1,3-benzodioxol-5-ylmethyl)piperazino]methyl}-1,3,5-triazin-2-yl)-N-(2,4-dimethylphenyl)amine
| Molecular Formula | C24H29N7O2 |
|---|---|
| Molecular Weight | 447.23828 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.23828 |
| Monoisotopic Mass | 447.23828 |
| Heavy Atoms | 33 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 774591-55-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C |
| InChIKey | KYJRGMDCAKWGPR-UHFFFAOYSA-N |
Product Overview
AC1LDFOT (CAS 774591-55-8), with molecular formula C24H29N7O2 and molecular weight 447.23828 g/mol. IUPAC: 6-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-N-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine.