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144236-73-7 | Piperidine, 4-[bis(4-fluorophenyl)methyl]-1-(2-naphthalenylmethyl)-
CAS No: 144236-73-7 Catalog No: AG001J6A MDL No:
Product Description
Catalog Number:
AG001J6A
Chemical Name:
Piperidine, 4-[bis(4-fluorophenyl)methyl]-1-(2-naphthalenylmethyl)-
CAS Number:
144236-73-7
Molecular Formula:
C29H27F2N
Molecular Weight:
427.5282
IUPAC Name:
4-[bis(4-fluorophenyl)methyl]-1-(naphthalen-2-ylmethyl)piperidine
InChI:
InChI=1S/C29H27F2N/c30-27-11-7-23(8-12-27)29(24-9-13-28(31)14-10-24)25-15-17-32(18-16-25)20-21-5-6-22-3-1-2-4-26(22)19-21/h1-14,19,25,29H,15-18,20H2
InChI Key:
MTXNLGFFZJZTIC-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(c1ccc(cc1)F)C1CCN(CC1)Cc1ccc2c(c1)cccc2
Properties
Complexity:
536
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.211g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
427.539g/mol
Monoisotopic Mass:
427.211g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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