SMILES:
CC1CC(C(=O)O)CCN1Cc1cccc(NC(=O)c2cccc(C(F)(F)F)n2)c1Molecular Processing
Molecular formula
C21H22F3N3O3
Molecular weight
421.42
Exact mass
421.1613
XLogP
4.04
TPSA
82.53
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
103.87
Supplementary Information
상세 정보 불러오는 중…
1개 반응에 참여→