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208184-69-4 | Benzeneacetamide, 2-bromo-N-[1-(phenylmethyl)-4-piperidinyl]-
CAS No: 208184-69-4 Catalog No: AG002JJE MDL No:
Product Description
Catalog Number:
AG002JJE
Chemical Name:
Benzeneacetamide, 2-bromo-N-[1-(phenylmethyl)-4-piperidinyl]-
CAS Number:
208184-69-4
Molecular Formula:
C20H23BrN2O
Molecular Weight:
387.3134
IUPAC Name:
N-(1-benzylpiperidin-4-yl)-2-(2-bromophenyl)acetamide
InChI:
InChI=1S/C20H23BrN2O/c21-19-9-5-4-8-17(19)14-20(24)22-18-10-12-23(13-11-18)15-16-6-2-1-3-7-16/h1-9,18H,10-15H2,(H,22,24)
InChI Key:
HWTWCGBXKVKYFN-UHFFFAOYSA-N
SMILES:
O=C(Cc1ccccc1Br)NC1CCN(CC1)Cc1ccccc1
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.099g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
387.321g/mol
Monoisotopic Mass:
386.099g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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