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148583-36-2 | Benzamide, 3-[[4-[2-(1-methylethoxy)phenyl]-1-piperazinyl]methyl]-
CAS No: 148583-36-2 Catalog No: AG001L1Z MDL No:
Product Description
Catalog Number:
AG001L1Z
Chemical Name:
Benzamide, 3-[[4-[2-(1-methylethoxy)phenyl]-1-piperazinyl]methyl]-
CAS Number:
148583-36-2
Molecular Formula:
C21H27N3O2
Molecular Weight:
353.4580
IUPAC Name:
3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]benzamide
InChI:
InChI=1S/C21H27N3O2/c1-16(2)26-20-9-4-3-8-19(20)24-12-10-23(11-13-24)15-17-6-5-7-18(14-17)21(22)25/h3-9,14,16H,10-13,15H2,1-2H3,(H2,22,25)
InChI Key:
GCZJGOGQCYPVPH-UHFFFAOYSA-N
SMILES:
CC(Oc1ccccc1N1CCN(CC1)Cc1cccc(c1)C(=O)N)C
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.21g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.466g/mol
Monoisotopic Mass:
353.21g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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