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1204297-16-4 | 4,7-Dimethoxy-N-(pyridin-4-ylmethyl)benzo[d]thiazol-2-amine
CAS No: 1204297-16-4 Catalog No: AG01FM1O MDL No:MFCD16631798
Product Description
Catalog Number:
AG01FM1O
Chemical Name:
4,7-Dimethoxy-N-(pyridin-4-ylmethyl)benzo[d]thiazol-2-amine
CAS Number:
1204297-16-4
Molecular Formula:
C15H15N3O2S
Molecular Weight:
301.3635
MDL Number:
MFCD16631798
IUPAC Name:
4,7-dimethoxy-N-(pyridin-4-ylmethyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C15H15N3O2S/c1-19-11-3-4-12(20-2)14-13(11)18-15(21-14)17-9-10-5-7-16-8-6-10/h3-8H,9H2,1-2H3,(H,17,18)
InChI Key:
GNBKJLXSECIDNK-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1sc(n2)NCc1ccncc1)OC
Properties
Complexity:
328
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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