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51784-73-7 | 2-(4-PIPERIDINYL)-1,3-BENZOTHIAZOLE
CAS No: 51784-73-7 Catalog No: AG00DBI8 MDL No:MFCD01815501
Product Description
Catalog Number:
AG00DBI8
Chemical Name:
2-(4-PIPERIDINYL)-1,3-BENZOTHIAZOLE
CAS Number:
51784-73-7
Molecular Formula:
C12H14N2S
Molecular Weight:
218.3180
MDL Number:
MFCD01815501
IUPAC Name:
2-piperidin-4-yl-1,3-benzothiazole
InChI:
InChI=1S/C12H14N2S/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-4,9,13H,5-8H2
InChI Key:
CYASANLJWAJEPW-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1nc2c(s1)cccc2
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.088g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.318g/mol
Monoisotopic Mass:
218.088g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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