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88067-32-7 | 4(1H)-Pyrimidinone, 6-phenyl-2-[(3-propyl-1,2,4-oxadiazol-5-yl)amino]-
CAS No: 88067-32-7 Catalog No: AG004I0I MDL No:
Product Description
Catalog Number:
AG004I0I
Chemical Name:
4(1H)-Pyrimidinone, 6-phenyl-2-[(3-propyl-1,2,4-oxadiazol-5-yl)amino]-
CAS Number:
88067-32-7
Molecular Formula:
C15H15N5O2
Molecular Weight:
297.3119
IUPAC Name:
4-phenyl-2-[(3-propyl-1,2,4-oxadiazol-5-yl)amino]-1H-pyrimidin-6-one
InChI:
InChI=1S/C15H15N5O2/c1-2-6-12-17-15(22-20-12)19-14-16-11(9-13(21)18-14)10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3,(H2,16,17,18,19,20,21)
InChI Key:
FZDIEOJNEURMMA-UHFFFAOYSA-N
SMILES:
CCCc1noc(n1)Nc1nc(=O)cc([nH]1)c1ccccc1
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.123g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.318g/mol
Monoisotopic Mass:
297.123g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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