SMILES:
CCNC(=O)c1cc2c(-c3ccccc3)nc(N)nc2s1Molecular Processing
Molecular formula
C15H14N4OS
Molecular weight
298.37
Exact mass
298.0888
XLogP
2.69
TPSA
80.9
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
85.27
Supplementary Information
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