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Home > Indoles and Oxindole > 176661-73-7
176661-73-7 | 1H-Indole, 5-(phenylmethoxy)-3-(1,2,3,6-tetrahydro-4-pyridinyl)-
CAS No: 176661-73-7 Catalog No: AG0024SQ MDL No:
Product Description
Catalog Number:
AG0024SQ
Chemical Name:
1H-Indole, 5-(phenylmethoxy)-3-(1,2,3,6-tetrahydro-4-pyridinyl)-
CAS Number:
176661-73-7
Molecular Formula:
C20H20N2O
Molecular Weight:
304.3856
IUPAC Name:
5-phenylmethoxy-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
InChI:
InChI=1S/C20H20N2O/c1-2-4-15(5-3-1)14-23-17-6-7-20-18(12-17)19(13-22-20)16-8-10-21-11-9-16/h1-8,12-13,21-22H,9-11,14H2
InChI Key:
WBFQMFPCSABJCS-UHFFFAOYSA-N
SMILES:
N1CCC(=CC1)c1c[nH]c2c1cc(OCc1ccccc1)cc2
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.158g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
304.393g/mol
Monoisotopic Mass:
304.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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