CCOC(=O)c1cc(CC)sc1NC(=O)C(C)C
名称: N-(3-carbethoxy-5-ethyl-2-thienyl)-2-methylpropanamide
SMILES: CCOC(=O)c1cc(CC)sc1NC(=O)C(C)C

Molecular Processing

Molecular formula
C13H19NO3S
Molecular weight
269.37
Exact mass
269.1086
XLogP
3.08
TPSA
55.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
73.12

Supplementary Information

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