名称: N-benzyl-2-ethynyl-4-methylthiazole-5-carboxamide
SMILES:
C#Cc1nc(C)c(C(=O)NCc2ccccc2)s1Molecular Processing
Molecular formula
C14H12N2OS
Molecular weight
256.33
Exact mass
256.067
XLogP
2.36
TPSA
41.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
72.4
Supplementary Information
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