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1289387-19-4 | 1-[1-(3-Methyl-2,3-dihydro-thiazol-2-yl)-ethyl]-piperidin-3-ol
CAS No: 1289387-19-4 Catalog No: AG01ERWQ MDL No:
Product Description
Catalog Number:
AG01ERWQ
Chemical Name:
1-[1-(3-Methyl-2,3-dihydro-thiazol-2-yl)-ethyl]-piperidin-3-ol
CAS Number:
1289387-19-4
Molecular Formula:
C11H20N2OS
Molecular Weight:
228.3543
IUPAC Name:
1-[1-(3-methyl-2H-1,3-thiazol-2-yl)ethyl]piperidin-3-ol
InChI:
InChI=1S/C11H20N2OS/c1-9(11-12(2)6-7-15-11)13-5-3-4-10(14)8-13/h6-7,9-11,14H,3-5,8H2,1-2H3
InChI Key:
LYGAFUROAPTUSD-UHFFFAOYSA-N
SMILES:
OC1CCCN(C1)C(C1SC=CN1C)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.13g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.354g/mol
Monoisotopic Mass:
228.13g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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