AC1LDDWI
4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,7,8-trimethylchromen-2-one
Also Known As: EiM08-01432|4-((4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)methyl)-5,7,8-trimethyl-2H-chromen-2-one|4-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-5,7,8-trimethyl-2H-chromen-2-one|F3385-1971|4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,7,8-trimethylchromen-2-one|4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-5,7,8-trimethyl-2H-chromen-2-one|4-{[4-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethyl)piperazinyl]methyl}-5,7,8-trimet hylchromen-2-one
| Molecular Formula | C25H28N2O4 |
|---|---|
| Molecular Weight | 420.2049 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.2049 |
| Monoisotopic Mass | 420.2049 |
| Heavy Atoms | 31 |
| Complexity | 689.0 |
Chemical Identifiers
| CAS Number | 850751-22-3 |
|---|---|
| SMILES | CC1=CC(=C2C(=CC(=O)OC2=C1C)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C |
| InChIKey | RURGSMZFQYJSPI-UHFFFAOYSA-N |
Product Overview
AC1LDDWI (CAS 850751-22-3), with molecular formula C25H28N2O4 and molecular weight 420.2049 g/mol. IUPAC: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,7,8-trimethylchromen-2-one.
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