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Home > Imidazoles > 203451-57-4
203451-57-4 | 1H-Benzimidazole, 2-(phenylmethyl)-6-[2-(4-phenyl-1-piperazinyl)ethyl]-
CAS No: 203451-57-4 Catalog No: AG0028VS MDL No:
Product Description
Catalog Number:
AG0028VS
Chemical Name:
1H-Benzimidazole, 2-(phenylmethyl)-6-[2-(4-phenyl-1-piperazinyl)ethyl]-
CAS Number:
203451-57-4
Molecular Formula:
C26H28N4
Molecular Weight:
396.5273
IUPAC Name:
2-benzyl-6-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-benzimidazole
InChI:
InChI=1S/C26H28N4/c1-3-7-21(8-4-1)20-26-27-24-12-11-22(19-25(24)28-26)13-14-29-15-17-30(18-16-29)23-9-5-2-6-10-23/h1-12,19H,13-18,20H2,(H,27,28)
InChI Key:
OSAXAUGFHGPTOK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cc1[nH]c2c(n1)ccc(c2)CCN1CCN(CC1)c1ccccc1
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.231g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
396.538g/mol
Monoisotopic Mass:
396.231g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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