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832696-85-2 | Thieno[3,2-c]pyridin-4-amine, 3-bromo-7-(4-pyridinyl)-
CAS No: 832696-85-2 Catalog No: AG0056RF MDL No:
Product Description
Catalog Number:
AG0056RF
Chemical Name:
Thieno[3,2-c]pyridin-4-amine, 3-bromo-7-(4-pyridinyl)-
CAS Number:
832696-85-2
Molecular Formula:
C12H8BrN3S
Molecular Weight:
306.1810
IUPAC Name:
3-bromo-7-pyridin-4-ylthieno[3,2-c]pyridin-4-amine
InChI:
InChI=1S/C12H8BrN3S/c13-9-6-17-11-8(5-16-12(14)10(9)11)7-1-3-15-4-2-7/h1-6H,(H2,14,16)
InChI Key:
DOEBGLQNIOLPGU-UHFFFAOYSA-N
SMILES:
Brc1csc2c1c(N)ncc2c1ccncc1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.962g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.181g/mol
Monoisotopic Mass:
304.962g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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