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380637-96-7 | 2-(PIPERIDIN-4-YLTHIO)BENZO[D]THIAZOLE
CAS No: 380637-96-7 Catalog No: AG00I7I1 MDL No:MFCD02942421
Product Description
Catalog Number:
AG00I7I1
Chemical Name:
2-(PIPERIDIN-4-YLTHIO)BENZO[D]THIAZOLE
CAS Number:
380637-96-7
MDL Number:
MFCD02942421
IUPAC Name:
2-piperidin-4-ylsulfanyl-1,3-benzothiazole
InChI:
InChI=1S/C12H14N2S2/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:
GHGDREBDLZLBSJ-UHFFFAOYSA-N
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.06g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.378g/mol
Monoisotopic Mass:
250.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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