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91599-59-6 | Imidazo(2,1-b)pyrido(2,3-f)quinazolin-9(10H)-one, 1,2,3,4,7,12-hexahydro-
CAS No: 91599-59-6 Catalog No: AG006SUY MDL No:
Product Description
Catalog Number:
AG006SUY
Chemical Name:
Imidazo(2,1-b)pyrido(2,3-f)quinazolin-9(10H)-one, 1,2,3,4,7,12-hexahydro-
CAS Number:
91599-59-6
Molecular Formula:
C13H14N4O
Molecular Weight:
242.2765
IUPAC Name:
3,11,13,16-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2(7),8,11-tetraen-14-one
InChI:
InChI=1S/C13H14N4O/c18-11-7-17-6-9-10(15-13(17)16-11)4-3-8-2-1-5-14-12(8)9/h3-4,14H,1-2,5-7H2,(H,15,16,18)
InChI Key:
GGOJTCNHGDZXIE-UHFFFAOYSA-N
SMILES:
O=C1N=C2N(C1)Cc1c(N2)ccc2c1NCCC2
UNII:
9ZM88LKK87
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.117g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.282g/mol
Monoisotopic Mass:
242.117g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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