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101782-77-8 | 1H-Pyrazol-5-amine, 1,4-diphenyl-3-propyl-
CAS No: 101782-77-8 Catalog No: AG0005KQ MDL No:
Product Description
Catalog Number:
AG0005KQ
Chemical Name:
1H-Pyrazol-5-amine, 1,4-diphenyl-3-propyl-
CAS Number:
101782-77-8
Molecular Formula:
C18H19N3
Molecular Weight:
277.3636
IUPAC Name:
2,4-diphenyl-5-propylpyrazol-3-amine
InChI:
InChI=1S/C18H19N3/c1-2-9-16-17(14-10-5-3-6-11-14)18(19)21(20-16)15-12-7-4-8-13-15/h3-8,10-13H,2,9,19H2,1H3
InChI Key:
YIHZTPFJCWMLRD-UHFFFAOYSA-N
SMILES:
CCCc1nn(c(c1c1ccccc1)N)c1ccccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.371g/mol
Monoisotopic Mass:
277.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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