이름: 3-(1-(4-methoxybenzyl)-3-methyl-1H-pyrazol-4-yl)-N-(pyridin-2-yl)-1,2,4-thiadiazol-5-amine
SMILES:
COc1ccc(Cn2cc(-c3nsc(Nc4ccccn4)n3)c(C)n2)cc1Molecular Processing
Molecular formula
C19H18N6OS
Molecular weight
378.46
Exact mass
378.1263
XLogP
3.91
TPSA
77.75
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
105.48
Supplementary Information
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