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88654-47-1 | Piperidine, 4-[4-(4-methoxyphenyl)-2-thiazolyl]-1-methyl-, hydrobromide
CAS No: 88654-47-1 Catalog No: AG0047VW MDL No:
Product Description
Catalog Number:
AG0047VW
Chemical Name:
Piperidine, 4-[4-(4-methoxyphenyl)-2-thiazolyl]-1-methyl-, hydrobromide
CAS Number:
88654-47-1
Molecular Formula:
C16H21BrN2OS
Molecular Weight:
369.3197
IUPAC Name:
4-(4-methoxyphenyl)-2-(1-methylpiperidin-4-yl)-1,3-thiazole;hydrobromide
InChI:
InChI=1S/C16H20N2OS.BrH/c1-18-9-7-13(8-10-18)16-17-15(11-20-16)12-3-5-14(19-2)6-4-12;/h3-6,11,13H,7-10H2,1-2H3;1H
InChI Key:
UIZZJPMWKZKFJP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1csc(n1)C1CCN(CC1)C.Br
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.056g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
369.321g/mol
Monoisotopic Mass:
368.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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