CBMicro_046936
3-(4-benzhydrylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: CBMicro_046936|Oprea1_442714|BIM-0046847.P001|AK-968/15359526|3-[(4-benzhydryl-1-piperazinyl)carbonyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid|3-(4-benzhydrylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid|3-{[4-(diphenylmethyl)piperazin-1-yl]carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid|2-(4-benzhydrylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid|3-[(4-BENZHYDRYLPIPERAZINO)CARBONYL]-7-OXABICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID|3-[4-(DIPHENYLMETHYL)PIPERAZINE-1-CARBONYL]-7-OXABICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID
| Molecular Formula | C25H28N2O4 |
|---|---|
| Molecular Weight | 420.2049 g/mol |
| LogP | 2.7984 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.2049 |
| Monoisotopic Mass | 420.2049 |
| Heavy Atoms | 31 |
| Complexity | 887.55286 |
Chemical Identifiers
| CAS Number | 489449-52-7 |
|---|---|
| SMILES | C1CC2C(C(C1O2)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O |
Product Overview
CBMicro_046936 (CAS 489449-52-7), with molecular formula C25H28N2O4 and molecular weight 420.2049 g/mol. IUPAC: 3-(4-benzhydrylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid.
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