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Home > Thiazole > 1185542-42-0
1185542-42-0 | 2-(Piperidin-4-yloxy)-1,3-benzothiazole
CAS No: 1185542-42-0 Catalog No: AG01APIC MDL No:MFCD16736290
Product Description
Catalog Number:
AG01APIC
Chemical Name:
2-(Piperidin-4-yloxy)-1,3-benzothiazole
CAS Number:
1185542-42-0
Molecular Formula:
C12H14N2OS
Molecular Weight:
234.3174
MDL Number:
MFCD16736290
IUPAC Name:
2-piperidin-4-yloxy-1,3-benzothiazole
InChI:
InChI=1S/C12H14N2OS/c1-2-4-11-10(3-1)14-12(16-11)15-9-5-7-13-8-6-9/h1-4,9,13H,5-8H2
InChI Key:
NHNWZAYGGKJMNS-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)Oc1nc2c(s1)cccc2
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.083g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.317g/mol
Monoisotopic Mass:
234.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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