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1201632-76-9

1201632-76-9 | 2(1H)-Quinazolinone, 4-(2-phenylethyl)-

CAS No: 1201632-76-9 Catalog No: AG000QES MDL No:

Product Description

Catalog Number:
AG000QES
Chemical Name:
2(1H)-Quinazolinone, 4-(2-phenylethyl)-
CAS Number:
1201632-76-9
Molecular Formula:
C16H14N2O
Molecular Weight:
250.2952
IUPAC Name:
4-(2-phenylethyl)-3H-quinazolin-2-one
InChI:
InChI=1S/C16H14N2O/c19-16-17-14-9-5-4-8-13(14)15(18-16)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18,19)
InChI Key:
IBRSHCFCFFXQHO-UHFFFAOYSA-N
SMILES:
O=c1nc(CCc2ccccc2)c2c([nH]1)cccc2

Properties

Complexity:
491  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.111g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.301g/mol
Monoisotopic Mass:
250.111g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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