الاسم: methyl 4-(4-ethenyl-1-methyl-1H-pyrazol-5-yl)-5-ethyl-2-thiophenecarboxylate
SMILES:
C=Cc1cnn(C)c1-c1cc(C(=O)OC)sc1CCMolecular Processing
Molecular formula
C14H16N2O2S
Molecular weight
276.36
Exact mass
276.0932
XLogP
3.14
TPSA
44.12
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
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
0.286
Molar refractivity
77.33
Supplementary Information
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