Name: 2-[(2-aminoethyl)amino]-4-(2,4-difluorophenyl)-8-(2-fluorophenyl)pyrido[2,3-d]pyrimidin-7(8H)-one
SMILES:
NCCNc1nc(-c2ccc(F)cc2F)c2ccc(=O)n(-c3ccccc3F)c2n1Molecular Processing
Molecular formula
C21H16F3N5O
Molecular weight
411.39
Exact mass
411.1307
XLogP
3.24
TPSA
85.83
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
107.99
Supplementary Information
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Involved in 3 reactions→