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136871-15-3 | 3-Piperidinamine, N-[(2-methoxyphenyl)methyl]-2,4-diphenyl-
CAS No: 136871-15-3 Catalog No: AG0012I5 MDL No:
Product Description
Catalog Number:
AG0012I5
Chemical Name:
3-Piperidinamine, N-[(2-methoxyphenyl)methyl]-2,4-diphenyl-
CAS Number:
136871-15-3
Molecular Formula:
C25H28N2O
Molecular Weight:
372.5026
IUPAC Name:
N-[(2-methoxyphenyl)methyl]-2,4-diphenylpiperidin-3-amine
InChI:
InChI=1S/C25H28N2O/c1-28-23-15-9-8-14-21(23)18-27-25-22(19-10-4-2-5-11-19)16-17-26-24(25)20-12-6-3-7-13-20/h2-15,22,24-27H,16-18H2,1H3
InChI Key:
XXXAPFHGQOEKLI-UHFFFAOYSA-N
SMILES:
COc1ccccc1CNC1C(CCNC1c1ccccc1)c1ccccc1
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.22g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
372.512g/mol
Monoisotopic Mass:
372.22g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
33.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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