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893613-49-5 | Pyrazolo[1,5-a]pyrimidine,6-(4-methoxyphenyl)-2-phenyl-
CAS No: 893613-49-5 Catalog No: AG003X59 MDL No:MFCD08056226
Product Description
Catalog Number:
AG003X59
Chemical Name:
Pyrazolo[1,5-a]pyrimidine,6-(4-methoxyphenyl)-2-phenyl-
CAS Number:
893613-49-5
Molecular Formula:
C19H15N3O
Molecular Weight:
301.3419
MDL Number:
MFCD08056226
IUPAC Name:
6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C19H15N3O/c1-23-17-9-7-14(8-10-17)16-12-20-19-11-18(21-22(19)13-16)15-5-3-2-4-6-15/h2-13H,1H3
InChI Key:
QXLNPACGOOKFHS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cnc2n(c1)nc(c2)c1ccccc1
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.122g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.349g/mol
Monoisotopic Mass:
301.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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