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1823371-80-7 | 4-bromo-2-(methylsulfanyl)pyrrolo[2,1-f][1,2,4]triazine
CAS No: 1823371-80-7 Catalog No: AG01FLBG MDL No:
Product Description
Catalog Number:
AG01FLBG
Chemical Name:
4-bromo-2-(methylsulfanyl)pyrrolo[2,1-f][1,2,4]triazine
CAS Number:
1823371-80-7
IUPAC Name:
4-bromo-2-methylsulfanylpyrrolo[2,1-f][1,2,4]triazine
InChI:
InChI=1S/C7H6BrN3S/c1-12-7-9-6(8)5-3-2-4-11(5)10-7/h2-4H,1H3
InChI Key:
NFDXYSLOIFNBKI-UHFFFAOYSA-N
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.947g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.11g/mol
Monoisotopic Mass:
242.947g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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