Name: methyl 4-(1-(2,5-dichloronicotinamido)cyclopropyl)benzoate
SMILES:
COC(=O)c1ccc(C2(NC(=O)c3cc(Cl)cnc3Cl)CC2)cc1Molecular Processing
Molecular formula
C17H14Cl2N2O3
Molecular weight
365.22
Exact mass
364.0381
XLogP
3.59
TPSA
68.29
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
90.42
Supplementary Information
Details werden geladen…
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