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88654-25-5 | Piperidine, 1-ethyl-4-(4-phenyl-2-thiazolyl)-
CAS No: 88654-25-5 Catalog No: AG0048Z8 MDL No:
Product Description
Catalog Number:
AG0048Z8
Chemical Name:
Piperidine, 1-ethyl-4-(4-phenyl-2-thiazolyl)-
CAS Number:
88654-25-5
Molecular Formula:
C16H20N2S
Molecular Weight:
272.4084
IUPAC Name:
2-(1-ethylpiperidin-4-yl)-4-phenyl-1,3-thiazole
InChI:
InChI=1S/C16H20N2S/c1-2-18-10-8-14(9-11-18)16-17-15(12-19-16)13-6-4-3-5-7-13/h3-7,12,14H,2,8-11H2,1H3
InChI Key:
HBSOOBOXJUXQTJ-UHFFFAOYSA-N
SMILES:
CCN1CCC(CC1)c1scc(n1)c1ccccc1
Properties
Complexity:
270
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:
3
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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