Basic information
- CAS
84176-75-0- Standard SMILES
c1ccc(CN2CCC(n3cnc4ccccc43)CC2)cc1- InChIKey
KYMRBSIZQUQJLF-UHFFFAOYSA-N- Molecular formula
- C19H21N3
- Average molar mass
- 291.4 g/mol
- Monoisotopic mass
- 291.17354768
Names & identifiers
- Preferred name
- 1-(1-(phenylmethyl)-4-piperidinyl)-1H-benzimidazole
- IUPAC
- 1-(1-benzylpiperidin-4-yl)benzimidazole
- English name
- 1-[1-(phenylmethyl)-4-piperidinyl]-1H-benzimidazole
- Molecular formula
- C19H21N3
- Molecular weight
- 291.39
Names & synonyms
84176-75-0EINECS 282-342-21-[1-(PHENYLMETHYL)-4-PIPERIDINYL]-1H-BENZIMIDAZOLE1-(1-(Phenylmethyl)-4-piperidinyl)-1H-benzimidazoleDTXSID40233097RefChem:73892DTXCID40155588282-342-21-(1-benzylpiperidin-4-yl)benzimidazoleSCHEMBL3132276AKOS000744458DA-02484
Show more names
1-(1-benzylpiperidin-4-yl)-1H-benzo[d]imidazole1H-Benzimidazole, 1-[1-(phenylmethyl)-4-piperidinyl]-
NS000384491-(1-Benzyl-piperidin-4-yl)-1-H-benzoimidazole1-(1-Benzylpiperidin-4-yl)-1H-1,3-benzimidazole
Database identifiers
- CAS
84176-75-0- PubChem CID
- 3019746
- DTXSID
DTXSID40233097- EC Number
- 282-342-2
- Nikkaji
- J333.061C
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 21.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 345
Physicochemical properties
- Melting point
- 142 · 142-143 °C
- Boiling point
- 454.9 · 454.9±55.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- pka
- 8.28 · 8.28±0.10(Predicted)
Chemistry & industry
Suppliers2 total
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
Related reactions
2 records
Compound notes
Loading…