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26773-65-9 | 2-(Piperidinothio)benzothiazole
CAS No: 26773-65-9 Catalog No: AG00CDX9 MDL No:
Product Description
Catalog Number:
AG00CDX9
Chemical Name:
2-(Piperidinothio)benzothiazole
CAS Number:
26773-65-9
IUPAC Name:
2-piperidin-1-ylsulfanyl-1,3-benzothiazole
InChI:
InChI=1S/C12H14N2S2/c1-4-8-14(9-5-1)16-12-13-10-6-2-3-7-11(10)15-12/h2-3,6-7H,1,4-5,8-9H2
InChI Key:
CAHGZULPDQXGMZ-UHFFFAOYSA-N
UNII:
02EEJ0WP97
NSC Number:
203009
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:
0
Isotope Atom Count:
0
Molecular Weight:
250.378g/mol
Monoisotopic Mass:
250.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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