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Home > Other Heterocycles > 1022401-68-8
1022401-68-8 | 2-phenyl-2,3,3',4'-tetrahydro-1'H-spiro[indene-1,2'-quinazoline]-3,4'-dione
CAS No: 1022401-68-8 Catalog No: AG00IX2Y MDL No:MFCD00955525
Product Description
Catalog Number:
AG00IX2Y
Chemical Name:
2-phenyl-2,3,3',4'-tetrahydro-1'H-spiro[indene-1,2'-quinazoline]-3,4'-dione
CAS Number:
1022401-68-8
Molecular Formula:
C22H16N2O2
Molecular Weight:
340.3746
MDL Number:
MFCD00955525
IUPAC Name:
2'-phenylspiro[1,3-dihydroquinazoline-2,3'-2H-indene]-1',4-dione
InChI:
InChI=1S/C22H16N2O2/c25-20-15-10-4-6-12-17(15)22(19(20)14-8-2-1-3-9-14)23-18-13-7-5-11-16(18)21(26)24-22/h1-13,19,23H,(H,24,26)
InChI Key:
SRDUOCKZHGTVPM-UHFFFAOYSA-N
SMILES:
O=C1NC2(Nc3c1cccc3)c1ccccc1C(=O)C2c1ccccc1
Properties
Complexity:
585
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.121g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
340.382g/mol
Monoisotopic Mass:
340.121g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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