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88654-23-3 | Piperidine, 1-methyl-4-[4-(4-methylphenyl)-2-thiazolyl]-
CAS No: 88654-23-3 Catalog No: AG0047W5 MDL No:
Product Description
Catalog Number:
AG0047W5
Chemical Name:
Piperidine, 1-methyl-4-[4-(4-methylphenyl)-2-thiazolyl]-
CAS Number:
88654-23-3
Molecular Formula:
C16H20N2S
Molecular Weight:
272.4084
IUPAC Name:
4-(4-methylphenyl)-2-(1-methylpiperidin-4-yl)-1,3-thiazole
InChI:
InChI=1S/C16H20N2S/c1-12-3-5-13(6-4-12)15-11-19-16(17-15)14-7-9-18(2)10-8-14/h3-6,11,14H,7-10H2,1-2H3
InChI Key:
VLVKCLMODXECKP-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)c1scc(n1)c1ccc(cc1)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.135g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.41g/mol
Monoisotopic Mass:
272.135g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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