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1420816-75-6 | 1H-Benzimidazole, 1-[(4-methylphenyl)methyl]-2-(4-piperidinyl)-, hydrochloride (1:1)
CAS No: 1420816-75-6 Catalog No: AG001HQR MDL No:
Product Description
Catalog Number:
AG001HQR
Chemical Name:
1H-Benzimidazole, 1-[(4-methylphenyl)methyl]-2-(4-piperidinyl)-, hydrochloride (1:1)
CAS Number:
1420816-75-6
Molecular Formula:
C20H24ClN3
Molecular Weight:
341.8777
IUPAC Name:
1-[(4-methylphenyl)methyl]-2-piperidin-4-ylbenzimidazole;hydrochloride
InChI:
InChI=1S/C20H23N3.ClH/c1-15-6-8-16(9-7-15)14-23-19-5-3-2-4-18(19)22-20(23)17-10-12-21-13-11-17;/h2-9,17,21H,10-14H2,1H3;1H
InChI Key:
CONZESXPCBYBFO-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Cn1c(nc2c1cccc2)C1CCNCC1.Cl
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.166g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.883g/mol
Monoisotopic Mass:
341.166g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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