الاسم: methyl 4-(1,4-dimethyl-1H-pyrazol-5-yl)-5-ethyl-2-thiophenecarboxylate
SMILES:
CCc1sc(C(=O)OC)cc1-c1c(C)cnn1CMolecular Processing
Molecular formula
C13H16N2O2S
Molecular weight
264.35
Exact mass
264.0932
XLogP
2.81
TPSA
44.12
H-bond donors
0
H-bond acceptors
4
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
5
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
71.98
Supplementary Information
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