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1105192-32-2 | 4,7-Dimethoxy-N-(pyridin-3-ylmethyl)benzo[d]thiazol-2-amine
CAS No: 1105192-32-2 Catalog No: AG01FM0H MDL No:MFCD11986772
Product Description
Catalog Number:
AG01FM0H
Chemical Name:
4,7-Dimethoxy-N-(pyridin-3-ylmethyl)benzo[d]thiazol-2-amine
CAS Number:
1105192-32-2
Molecular Formula:
C15H15N3O2S
Molecular Weight:
301.3635
MDL Number:
MFCD11986772
IUPAC Name:
4,7-dimethoxy-N-(pyridin-3-ylmethyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C15H15N3O2S/c1-19-11-5-6-12(20-2)14-13(11)18-15(21-14)17-9-10-4-3-7-16-8-10/h3-8H,9H2,1-2H3,(H,17,18)
InChI Key:
MTHXZSDELLIGNO-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1sc(n2)NCc1cccnc1)OC
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.088g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.364g/mol
Monoisotopic Mass:
301.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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