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120013-45-8 | Piperidine, 4-[(5,6-dimethoxy-1H-inden-2-yl)methyl]-1-(phenylmethyl)-
CAS No: 120013-45-8 Catalog No: AG000Q2P MDL No:
Product Description
Catalog Number:
AG000Q2P
Chemical Name:
Piperidine, 4-[(5,6-dimethoxy-1H-inden-2-yl)methyl]-1-(phenylmethyl)-
CAS Number:
120013-45-8
Molecular Formula:
C24H29NO2
Molecular Weight:
363.4926
IUPAC Name:
1-benzyl-4-[(5,6-dimethoxy-1H-inden-2-yl)methyl]piperidine
InChI:
InChI=1S/C24H29NO2/c1-26-23-15-21-13-20(14-22(21)16-24(23)27-2)12-18-8-10-25(11-9-18)17-19-6-4-3-5-7-19/h3-7,13,15-16,18H,8-12,14,17H2,1-2H3
InChI Key:
WEXHLNQRFRJSQX-UHFFFAOYSA-N
SMILES:
COc1cc2C=C(Cc2cc1OC)CC1CCN(CC1)Cc1ccccc1
UNII:
YG0F70BY09
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.22g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
363.501g/mol
Monoisotopic Mass:
363.22g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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