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88491-50-3 | Pyrrolo[2,1-b]quinazolin-9(1H)-one, 2,3,5,6,7,8-hexahydro-
CAS No: 88491-50-3 Catalog No: AG0049QM MDL No:
Product Description
Catalog Number:
AG0049QM
Chemical Name:
Pyrrolo[2,1-b]quinazolin-9(1H)-one, 2,3,5,6,7,8-hexahydro-
CAS Number:
88491-50-3
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
IUPAC Name:
2,3,5,6,7,8-hexahydro-1H-pyrrolo[2,1-b]quinazolin-9-one
InChI:
InChI=1S/C11H14N2O/c14-11-8-4-1-2-5-9(8)12-10-6-3-7-13(10)11/h1-7H2
InChI Key:
OACRPJICGZAYFE-UHFFFAOYSA-N
SMILES:
O=c1c2CCCCc2nc2n1CCC2
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.246g/mol
Monoisotopic Mass:
190.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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