Name: 2,5-dichloro-N-(1-methyl-1-phenylethyl)nicotinamide
SMILES:
CC(C)(NC(=O)c1cc(Cl)cnc1Cl)c1ccccc1Molecular Processing
Molecular formula
C15H14Cl2N2O
Molecular weight
309.2
Exact mass
308.0483
XLogP
4.05
TPSA
41.99
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
81.19
Supplementary Information
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