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1086775-07-6 | 12-Benzyl-12b-methyl-1,2,3,6,7,12b-hexahydroindolo[2,3-a]quinolizin-4(12H);-one
CAS No: 1086775-07-6 Catalog No: AG007C3Q MDL No:
Product Description
Catalog Number:
AG007C3Q
Chemical Name:
12-Benzyl-12b-methyl-1,2,3,6,7,12b-hexahydroindolo[2,3-a]quinolizin-4(12H);-one
CAS Number:
1086775-07-6
Molecular Formula:
C23H24N2O
Molecular Weight:
344.4495
IUPAC Name:
12-benzyl-12b-methyl-2,3,6,7-tetrahydro-1H-indolo[2,3-a]quinolizin-4-one
InChI:
InChI=1S/C23H24N2O/c1-23-14-7-12-21(26)25(23)15-13-19-18-10-5-6-11-20(18)24(22(19)23)16-17-8-3-2-4-9-17/h2-6,8-11H,7,12-16H2,1H3
InChI Key:
JVSJJJJSMLYLDV-UHFFFAOYSA-N
SMILES:
O=C1CCCC2(N1CCc1c2n(Cc2ccccc2)c2c1cccc2)C
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.189g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.458g/mol
Monoisotopic Mass:
344.189g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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