Home Halogens Thieno[3,2-b]pyridin-7-amine, 2-bromo-N-[3-[(4-methoxyphenyl)methoxy]phenyl]-

Thieno[3,2-b]pyridin-7-amine, 2-bromo-N-[3-[(4-methoxyphenyl)methoxy]phenyl]-

CAS No.:
1228102-89-3
Catalog Number:
AG000JIO
Molecular Formula:
C21H17BrN2O2S
Molecular Weight:
441.3409
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Product Description
Catalog Number:
AG000JIO
Chemical Name:
Thieno[3,2-b]pyridin-7-amine, 2-bromo-N-[3-[(4-methoxyphenyl)methoxy]phenyl]-
CAS Number:
1228102-89-3
Molecular Formula:
C21H17BrN2O2S
Molecular Weight:
441.3409
MDL Number:
MFCD29918546
IUPAC Name:
2-bromo-N-[3-[(4-methoxyphenyl)methoxy]phenyl]thieno[3,2-b]pyridin-7-amine
InChI:
InChI=1S/C21H17BrN2O2S/c1-25-16-7-5-14(6-8-16)13-26-17-4-2-3-15(11-17)24-18-9-10-23-19-12-20(22)27-21(18)19/h2-12H,13H2,1H3,(H,23,24)
InChI Key:
XKVMMXOPGCYSIB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COc1cccc(c1)Nc1ccnc2c1sc(c2)Br
Properties
Complexity:
464  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
440.019g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
441.343g/mol
Monoisotopic Mass:
440.019g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  
Properties