Basic information
- CAS
680233-09-4- Standard SMILES
OC1CCN(c2nc3ccccc3n2Cc2ccc(F)cc2)CC1- InChIKey
LZURHWFFYLEBSW-UHFFFAOYSA-N- Molecular formula
- C19H20FN3O
- Average molar mass
- 325.4 g/mol
Names & identifiers
- Preferred name
- 1-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ol
- IUPAC
- 1-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]piperidin-4-ol
- English name
- 1-(1-(4-Fluorobenzyl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ol(WXG02520)
- Molecular formula
- C19H20FN3O
- Molecular weight
- 325.38
Names & synonyms
1-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ol680233-09-4SCHEMBL5229655LZURHWFFYLEBSW-UHFFFAOYSA-NDB-2254231-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]piperidin-4-ol1-[1-(4-Fluorobenzyl)-1H-benzimidazol-2-yl]-4-hydroxypiperidine4-Piperidinol, 1-[1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl]-1-(1-(4-Fluorobenzyl)-1H-benzo[d]imidazol-2-yl)piperidin-4-ol(WXG02520)
Database identifiers
- CAS
680233-09-4
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Boiling point
- 534.2 · 534.2±60.0 °C(Predicted)
- Density
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 14.7 · 14.70±0.20(Predicted)
Chemistry & industry
Suppliers3 total
苏州美石生物科技有限公司1173954148q · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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