Cc1ccc(-c2cc(C(=O)NC(C)c3cnc(C(F)(F)F)nc3)cc(C(C)C)n2)nc1
SMILES: Cc1ccc(-c2cc(C(=O)NC(C)c3cnc(C(F)(F)F)nc3)cc(C(C)C)n2)nc1

Molecular Processing

Molecular formula
C22H22F3N5O
Molecular weight
429.45
Exact mass
429.1776
XLogP
4.88
TPSA
80.66
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
109.21

Supplementary Information

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