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60248-24-0 | 3-[2-[(4-cinnamyl-1-piperazinyl)methyl]-1H-benzimidazol-1-yl]-1-(2-furyl)propan-1-one dimaleate
CAS No: 60248-24-0 Catalog No: AG00ERE8 MDL No:
Product Description
Catalog Number:
AG00ERE8
Chemical Name:
3-[2-[(4-cinnamyl-1-piperazinyl)methyl]-1H-benzimidazol-1-yl]-1-(2-furyl)propan-1-one dimaleate
CAS Number:
60248-24-0
IUPAC Name:
(E)-but-2-enedioic acid;1-(furan-2-yl)-3-[2-[[4-[(Z)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]benzimidazol-1-yl]propan-1-one
InChI:
InChI=1S/C28H30N4O2.2C4H4O4/c33-26(27-13-7-21-34-27)14-16-32-25-12-5-4-11-24(25)29-28(32)22-31-19-17-30(18-20-31)15-6-10-23-8-2-1-3-9-23;2*5-3(6)1-2-4(7)8/h1-13,21H,14-20,22H2;2*1-2H,(H,5,6)(H,7,8)/b10-6-;2*2-1+
InChI Key:
DDYRUOXRYVBENR-KGCCCFOJSA-N
EC Number:
262-124-3
Properties
Complexity:
790
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
3
Exact Mass:
686.259g/mol
Formal Charge:
0
Heavy Atom Count:
50
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
686.718g/mol
Monoisotopic Mass:
686.259g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
204A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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