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Home > Indoles and Oxindole > 787543-07-1
787543-07-1 | 6-(benzo[d][1,3]dioxol-5-yl)-2,3,4,6-tetrahydropyriMido[2,1-a]isoindol-6-ol
CAS No: 787543-07-1 Catalog No: AG00GC57 MDL No:
Product Description
Catalog Number:
AG00GC57
Chemical Name:
6-(benzo[d][1,3]dioxol-5-yl)-2,3,4,6-tetrahydropyriMido[2,1-a]isoindol-6-ol
CAS Number:
787543-07-1
IUPAC Name:
6-(1,3-benzodioxol-5-yl)-3,4-dihydro-2H-pyrimido[1,2-b]isoindol-6-ol
InChI:
InChI=1S/C18H16N2O3/c21-18(12-6-7-15-16(10-12)23-11-22-15)14-5-2-1-4-13(14)17-19-8-3-9-20(17)18/h1-2,4-7,10,21H,3,8-9,11H2
InChI Key:
WCGSHYCCXQCRIA-UHFFFAOYSA-N
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.116g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.337g/mol
Monoisotopic Mass:
308.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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