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120546-70-5 | Thiazolo[5,4-h]isoquinolin-2(1H)-one
CAS No: 120546-70-5 Catalog No: AG0080YE MDL No:MFCD24595188
Product Description
Catalog Number:
AG0080YE
Chemical Name:
Thiazolo[5,4-h]isoquinolin-2(1H)-one
CAS Number:
120546-70-5
Molecular Formula:
C10H6N2OS
Molecular Weight:
202.2324
MDL Number:
MFCD24595188
IUPAC Name:
1H-[1,3]thiazolo[5,4-h]isoquinolin-2-one
InChI:
InChI=1S/C10H6N2OS/c13-10-12-9-7-5-11-4-3-6(7)1-2-8(9)14-10/h1-5H,(H,12,13)
InChI Key:
OESRPZVDCPNWTK-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c(s1)ccc1c2cncc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.231g/mol
Monoisotopic Mass:
202.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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