CC1(c2cc(N)ccc2Cl)N=C(N)OCC1(F)F
SMILES: CC1(c2cc(N)ccc2Cl)N=C(N)OCC1(F)F

Molecular Processing

Molecular formula
C11H12ClF2N3O
Molecular weight
275.69
Exact mass
275.0637
XLogP
2.12
TPSA
73.63
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
65.74

Supplementary Information

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