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193208-83-2 | 7H-Imidazo[4,5-g]indolizin-7-one, 1,4,5,8,9,9a-hexahydro-
CAS No: 193208-83-2 Catalog No: AG0073GP MDL No:
Product Description
Catalog Number:
AG0073GP
Chemical Name:
7H-Imidazo[4,5-g]indolizin-7-one, 1,4,5,8,9,9a-hexahydro-
CAS Number:
193208-83-2
Molecular Formula:
C9H11N3O
Molecular Weight:
177.2031
IUPAC Name:
3,4,5,8,9,9a-hexahydroimidazo[4,5-g]indolizin-7-one
InChI:
InChI=1S/C9H11N3O/c13-8-2-1-7-9-6(10-5-11-9)3-4-12(7)8/h5,7H,1-4H2,(H,10,11)
InChI Key:
JSYOMXUUMNHGJO-UHFFFAOYSA-N
SMILES:
O=C1CCC2N1CCc1c2[nH]cn1
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.09g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.207g/mol
Monoisotopic Mass:
177.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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