Dihydro Donepezil, trans-
Basic information
- CAS
172602-75-4- Standard SMILES
COc1cc2c(cc1OC)[C@@H](O)[C@H](CC1CCN(Cc3ccccc3)CC1)C2- InChIKey
UGTUAFCYSWJIHS-YKSBVNFPSA-N- Molecular formula
- C24H31NO3
- Average molar mass
- 381.5 g/mol
- Monoisotopic mass
- 381.23039385
Names & identifiers
- Preferred name
- Dihydro Donepezil, trans-
- IUPAC
- (1S,2R)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-ol
Names & synonyms
Dihydro Donepezil, trans-G956SX94EG172602-75-41H-Inden-1-ol, 2,3-dihydro-5,6-dimethoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methyl]-, trans-
Database identifiers
- CAS
172602-75-4- PubChem CID
- 92209232
- UNII
- G956SX94EG
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 472
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…