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88976-10-7 | 4(1H)-Quinazolinone, 2-(2-methylpropyl)-
CAS No: 88976-10-7 Catalog No: AG0045QS MDL No:
Product Description
Catalog Number:
AG0045QS
Chemical Name:
4(1H)-Quinazolinone, 2-(2-methylpropyl)-
CAS Number:
88976-10-7
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
2-(2-methylpropyl)-3H-quinazolin-4-one
InChI:
InChI=1S/C12H14N2O/c1-8(2)7-11-13-10-6-4-3-5-9(10)12(15)14-11/h3-6,8H,7H2,1-2H3,(H,13,14,15)
InChI Key:
GUZJGBCZBUEHTB-UHFFFAOYSA-N
SMILES:
CC(Cc1nc(=O)c2c([nH]1)cccc2)C
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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