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1637465-83-8 | Dibenzo[f,h]quinazolin-2(1H)-one
CAS No: 1637465-83-8 Catalog No: AG001UD2 MDL No:
Product Description
Catalog Number:
AG001UD2
Chemical Name:
Dibenzo[f,h]quinazolin-2(1H)-one
CAS Number:
1637465-83-8
Molecular Formula:
C16H10N2O
Molecular Weight:
246.2634
IUPAC Name:
1H-phenanthro[9,10-d]pyrimidin-2-one
InChI:
InChI=1S/C16H10N2O/c19-16-17-9-14-12-7-2-1-5-10(12)11-6-3-4-8-13(11)15(14)18-16/h1-9H,(H,17,18,19)
InChI Key:
CIVBGLMVZGQCJN-UHFFFAOYSA-N
SMILES:
O=c1ncc2c([nH]1)c1ccccc1c1c2cccc1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.269g/mol
Monoisotopic Mass:
246.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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