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19767-25-0 | 1,2-Benzisothiazole, 3-[2-(1-piperidinyl)ethoxy]-
CAS No: 19767-25-0 Catalog No: AG002AYP MDL No:
Product Description
Catalog Number:
AG002AYP
Chemical Name:
1,2-Benzisothiazole, 3-[2-(1-piperidinyl)ethoxy]-
CAS Number:
19767-25-0
Molecular Formula:
C14H18N2OS
Molecular Weight:
262.3705
IUPAC Name:
3-(2-piperidin-1-ylethoxy)-1,2-benzothiazole
InChI:
InChI=1S/C14H18N2OS/c1-4-8-16(9-5-1)10-11-17-14-12-6-2-3-7-13(12)18-15-14/h2-3,6-7H,1,4-5,8-11H2
InChI Key:
MSIQTUORZDHNAQ-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)CCOc1nsc2c1cccc2
EC Number:
243-284-3
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.114g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.371g/mol
Monoisotopic Mass:
262.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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