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Home > Indoles and Oxindole > 101670-78-4
101670-78-4 | Methanone, [5-(phenylmethoxy)-1H-indol-3-yl]-4-piperidinyl-
CAS No: 101670-78-4 Catalog No: AG00055Q MDL No:
Product Description
Catalog Number:
AG00055Q
Chemical Name:
Methanone, [5-(phenylmethoxy)-1H-indol-3-yl]-4-piperidinyl-
CAS Number:
101670-78-4
Molecular Formula:
C21H22N2O2
Molecular Weight:
334.4116
IUPAC Name:
(5-phenylmethoxy-1H-indol-3-yl)-piperidin-4-ylmethanone
InChI:
InChI=1S/C21H22N2O2/c24-21(16-8-10-22-11-9-16)19-13-23-20-7-6-17(12-18(19)20)25-14-15-4-2-1-3-5-15/h1-7,12-13,16,22-23H,8-11,14H2
InChI Key:
IMVYEAYZQOEKCO-UHFFFAOYSA-N
SMILES:
O=C(c1c[nH]c2c1cc(OCc1ccccc1)cc2)C1CCNCC1
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.168g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
334.419g/mol
Monoisotopic Mass:
334.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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