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397274-77-0 | Piperidine, 4-[4-(1H-imidazol-1-yl)phenoxy]-1-(1-methylethyl)-
CAS No: 397274-77-0 Catalog No: AG0077UB MDL No:
Product Description
Catalog Number:
AG0077UB
Chemical Name:
Piperidine, 4-[4-(1H-imidazol-1-yl)phenoxy]-1-(1-methylethyl)-
CAS Number:
397274-77-0
Molecular Formula:
C17H23N3O
Molecular Weight:
285.3840
IUPAC Name:
4-(4-imidazol-1-ylphenoxy)-1-propan-2-ylpiperidine
InChI:
InChI=1S/C17H23N3O/c1-14(2)19-10-7-17(8-11-19)21-16-5-3-15(4-6-16)20-12-9-18-13-20/h3-6,9,12-14,17H,7-8,10-11H2,1-2H3
InChI Key:
WWKOFIKGDOBUKU-UHFFFAOYSA-N
SMILES:
CC(N1CCC(CC1)Oc1ccc(cc1)n1cncc1)C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.184g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.391g/mol
Monoisotopic Mass:
285.184g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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