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Home > Indoles and Oxindole > 827015-52-1
827015-52-1 | 1H-Indole, 3-[(4-phenyl-1-piperidinyl)methyl]-2-(2-pyridinyl)-
CAS No: 827015-52-1 Catalog No: AG0051SE MDL No:
Product Description
Catalog Number:
AG0051SE
Chemical Name:
1H-Indole, 3-[(4-phenyl-1-piperidinyl)methyl]-2-(2-pyridinyl)-
CAS Number:
827015-52-1
Molecular Formula:
C25H25N3
Molecular Weight:
367.4861
IUPAC Name:
3-[(4-phenylpiperidin-1-yl)methyl]-2-pyridin-2-yl-1H-indole
InChI:
InChI=1S/C25H25N3/c1-2-8-19(9-3-1)20-13-16-28(17-14-20)18-22-21-10-4-5-11-23(21)27-25(22)24-12-6-7-15-26-24/h1-12,15,20,27H,13-14,16-18H2
InChI Key:
JUYKRHKYRFLKOJ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1CCN(CC1)Cc1c([nH]c2c1cccc2)c1ccccn1
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.205g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
367.496g/mol
Monoisotopic Mass:
367.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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