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758716-60-8 | 3H-Oxazolo[3,4-a]thieno[3,4-c]pyridin-3-one, 1-(2,5-dimethyl-3-thienyl)-5,6-dihydro-7,9-dimethyl-
CAS No: 758716-60-8 Catalog No: AG00GDTT MDL No:
Product Description
Catalog Number:
AG00GDTT
Chemical Name:
3H-Oxazolo[3,4-a]thieno[3,4-c]pyridin-3-one, 1-(2,5-dimethyl-3-thienyl)-5,6-dihydro-7,9-dimethyl-
CAS Number:
758716-60-8
IUPAC Name:
3-(2,5-dimethylthiophen-3-yl)-10,12-dimethyl-4-oxa-11-thia-6-azatricyclo[7.3.0.02,6]dodeca-1(12),2,9-trien-5-one
InChI:
InChI=1S/C17H17NO2S2/c1-8-7-13(10(3)21-8)16-15-14-11(4)22-9(2)12(14)5-6-18(15)17(19)20-16/h7H,5-6H2,1-4H3
InChI Key:
YEODLKJPLGPRDR-UHFFFAOYSA-N
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.07g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.448g/mol
Monoisotopic Mass:
331.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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