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26313-51-9 | 2(1H)-Quinazolinone, 6-chloro-1-(2-ethoxyethyl)-4-(2-fluorophenyl)-
CAS No: 26313-51-9 Catalog No: AG002SOZ MDL No:
Product Description
Catalog Number:
AG002SOZ
Chemical Name:
2(1H)-Quinazolinone, 6-chloro-1-(2-ethoxyethyl)-4-(2-fluorophenyl)-
CAS Number:
26313-51-9
Molecular Formula:
C18H16ClFN2O2
Molecular Weight:
346.7832
IUPAC Name:
6-chloro-1-(2-ethoxyethyl)-4-(2-fluorophenyl)quinazolin-2-one
InChI:
InChI=1S/C18H16ClFN2O2/c1-2-24-10-9-22-16-8-7-12(19)11-14(16)17(21-18(22)23)13-5-3-4-6-15(13)20/h3-8,11H,2,9-10H2,1H3
InChI Key:
ASVDKQXETKERME-UHFFFAOYSA-N
SMILES:
CCOCCn1c(=O)nc(c2c1ccc(c2)Cl)c1ccccc1F
Properties
Complexity:
488
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.088g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.786g/mol
Monoisotopic Mass:
346.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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