CCCc1nn(C)c(C(N)=O)c1NC(=O)c1ccccc1OCC
名称: 4-(2-Ethoxybenzamido)-1-methyl-3-n-propylpyrazole-5-carboxamide
SMILES: CCCc1nn(C)c(C(N)=O)c1NC(=O)c1ccccc1OCC

Molecular Processing

Molecular formula
C17H22N4O3
Molecular weight
330.39
Exact mass
330.1692
XLogP
2.12
TPSA
99.24
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
91.29

Supplementary Information

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