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310422-25-4 | 7-Amino-2,5-diphenylpyrazolo[1,5-a]pyrimidine
CAS No: 310422-25-4 Catalog No: AG01FAHC MDL No:MFCD01053019
Product Description
Catalog Number:
AG01FAHC
Chemical Name:
7-Amino-2,5-diphenylpyrazolo[1,5-a]pyrimidine
CAS Number:
310422-25-4
Molecular Formula:
C18H14N4
Molecular Weight:
286.3306
MDL Number:
MFCD01053019
IUPAC Name:
2,5-diphenylpyrazolo[1,5-a]pyrimidin-7-amine
InChI:
InChI=1S/C18H14N4/c19-17-11-15(13-7-3-1-4-8-13)20-18-12-16(21-22(17)18)14-9-5-2-6-10-14/h1-12H,19H2
InChI Key:
RNCCCLVDZHMPAW-UHFFFAOYSA-N
SMILES:
Nc1cc(nc2n1nc(c2)c1ccccc1)c1ccccc1
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.122g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.338g/mol
Monoisotopic Mass:
286.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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