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1396877-26-1

1396877-26-1 | 4-METHOXY-2-(PIPERIDIN-4-YLOXY)BENZO[D]THIAZOLE HYDROCHLORIDE

CAS No: 1396877-26-1 Catalog No: AG01AS0E MDL No:MFCD22587639

Product Description

Catalog Number:
AG01AS0E
Chemical Name:
4-METHOXY-2-(PIPERIDIN-4-YLOXY)BENZO[D]THIAZOLE HYDROCHLORIDE
CAS Number:
1396877-26-1
Molecular Formula:
C13H17ClN2O2S
Molecular Weight:
300.8043
MDL Number:
MFCD22587639
IUPAC Name:
4-methoxy-2-piperidin-4-yloxy-1,3-benzothiazole;hydrochloride
InChI:
InChI=1S/C13H16N2O2S.ClH/c1-16-10-3-2-4-11-12(10)15-13(18-11)17-9-5-7-14-8-6-9;/h2-4,9,14H,5-8H2,1H3;1H
InChI Key:
PQLJKVONMALRMD-UHFFFAOYSA-N
SMILES:
COc1cccc2c1nc(s2)OC1CCNCC1.Cl

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.07g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
300.801g/mol
Monoisotopic Mass:
300.07g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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