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188739-03-9 | 1H-Thiopyrano[3,4-b]quinolin-4(3H)-one
CAS No: 188739-03-9 Catalog No: AG002H8T MDL No:
Product Description
Catalog Number:
AG002H8T
Chemical Name:
1H-Thiopyrano[3,4-b]quinolin-4(3H)-one
CAS Number:
188739-03-9
Molecular Formula:
C12H9NOS
Molecular Weight:
215.2710
IUPAC Name:
1H-thiopyrano[3,4-b]quinolin-4-one
InChI:
InChI=1S/C12H9NOS/c14-12-7-15-6-11-9(12)5-8-3-1-2-4-10(8)13-11/h1-5H,6-7H2
InChI Key:
HXNMOWPPKDGURM-UHFFFAOYSA-N
SMILES:
O=C1CSCc2c1cc1ccccc1n2
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.27g/mol
Monoisotopic Mass:
215.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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