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177162-41-3 | Thiazolo[5,4-d]isothiazol-5-amine
CAS No: 177162-41-3 Catalog No: AG00255A MDL No:
Product Description
Catalog Number:
AG00255A
Chemical Name:
Thiazolo[5,4-d]isothiazol-5-amine
CAS Number:
177162-41-3
Molecular Formula:
C4H3N3S2
Molecular Weight:
157.2167
IUPAC Name:
[1,2]thiazolo[5,4-d][1,3]thiazol-5-amine
InChI:
InChI=1S/C4H3N3S2/c5-4-7-3-2(8-4)1-6-9-3/h1H,(H2,5,7)
InChI Key:
ZZZUHCINCFZFAR-UHFFFAOYSA-N
SMILES:
Nc1sc2c(n1)snc2
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.977g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.209g/mol
Monoisotopic Mass:
156.977g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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