名称: 1-(2-Carbomethoxybenzoyl)-2-methyl-4-(3-fluorophenyl)-3-thiosemicarbazide
SMILES:
COC(=O)c1ccccc1C(=O)NN(C)C(=S)Nc1cccc(F)c1Molecular Processing
Molecular formula
C17H16FN3O3S
Molecular weight
361.4
Exact mass
361.0896
XLogP
2.59
TPSA
70.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
95.63
Supplementary Information
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