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20873-11-4 | 2-Quinazolinecarboxaldehyde, 3,4-dihydro-4-oxo-3-phenyl-
CAS No: 20873-11-4 Catalog No: AG002JVH MDL No:
Product Description
Catalog Number:
AG002JVH
Chemical Name:
2-Quinazolinecarboxaldehyde, 3,4-dihydro-4-oxo-3-phenyl-
CAS Number:
20873-11-4
Molecular Formula:
C15H10N2O2
Molecular Weight:
250.2521
IUPAC Name:
4-oxo-3-phenylquinazoline-2-carbaldehyde
InChI:
InChI=1S/C15H10N2O2/c18-10-14-16-13-9-5-4-8-12(13)15(19)17(14)11-6-2-1-3-7-11/h1-10H
InChI Key:
XBDKMPXYQXELAW-UHFFFAOYSA-N
SMILES:
O=Cc1nc2ccccc2c(=O)n1c1ccccc1
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.074g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.257g/mol
Monoisotopic Mass:
250.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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