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1426290-30-3 | 4,7-dimethyl-2-(piperidin-4-yloxy)-1,3-benzothiazole hydrochloride
CAS No: 1426290-30-3 Catalog No: AG01ARYR MDL No:MFCD24387579
Product Description
Catalog Number:
AG01ARYR
Chemical Name:
4,7-dimethyl-2-(piperidin-4-yloxy)-1,3-benzothiazole hydrochloride
CAS Number:
1426290-30-3
Molecular Formula:
C14H19ClN2OS
Molecular Weight:
298.8315
MDL Number:
MFCD24387579
IUPAC Name:
4,7-dimethyl-2-piperidin-4-yloxy-1,3-benzothiazole;hydrochloride
InChI:
InChI=1S/C14H18N2OS.ClH/c1-9-3-4-10(2)13-12(9)16-14(18-13)17-11-5-7-15-8-6-11;/h3-4,11,15H,5-8H2,1-2H3;1H
InChI Key:
SKZMMNSQPKHIIN-UHFFFAOYSA-N
SMILES:
Cc1ccc(c2c1sc(n2)OC1CCNCC1)C.Cl
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.091g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
298.829g/mol
Monoisotopic Mass:
298.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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