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129799-93-5 | Imidazo[1,5-a]quinoxalin-4(5H)-one, 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-(1,1-dimethylethyl)-
CAS No: 129799-93-5 Catalog No: AG000TP0 MDL No:
Product Description
Catalog Number:
AG000TP0
Chemical Name:
Imidazo[1,5-a]quinoxalin-4(5H)-one, 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-(1,1-dimethylethyl)-
CAS Number:
129799-93-5
Molecular Formula:
C19H19N5O2
Molecular Weight:
349.3865
IUPAC Name:
5-tert-butyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)imidazo[1,5-a]quinoxalin-4-one
InChI:
InChI=1S/C19H19N5O2/c1-19(2,3)24-13-7-5-4-6-12(13)23-10-20-14(15(23)18(24)25)16-21-17(26-22-16)11-8-9-11/h4-7,10-11H,8-9H2,1-3H3
InChI Key:
MVQHDTIAGNSFNE-UHFFFAOYSA-N
SMILES:
O=c1c2c(ncn2c2c(n1C(C)(C)C)cccc2)c1noc(n1)C1CC1
Properties
Complexity:
575
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.154g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.394g/mol
Monoisotopic Mass:
349.154g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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