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909645-87-0 | 2-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-1H-benzimidazole
CAS No: 909645-87-0 Catalog No: AG00IGDF MDL No:MFCD08562692
Product Description
Catalog Number:
AG00IGDF
Chemical Name:
2-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-1H-benzimidazole
CAS Number:
909645-87-0
Molecular Formula:
C18H20N4
Molecular Weight:
292.3782
MDL Number:
MFCD08562692
IUPAC Name:
2-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-1H-benzimidazole
InChI:
InChI=1S/C18H20N4/c1-2-6-17-16(5-1)20-18(21-17)15-7-10-22(11-8-15)13-14-4-3-9-19-12-14/h1-6,9,12,15H,7-8,10-11,13H2,(H,20,21)
InChI Key:
MIJMOIPZRLTRSK-UHFFFAOYSA-N
SMILES:
c1ccc(cn1)CN1CCC(CC1)c1nc2c([nH]1)cccc2
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.169g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.386g/mol
Monoisotopic Mass:
292.169g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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