이름: 4-chloro-3-(3-ethyl-1H-1,2,4-triazol-5-yl)thiophen-2-amine
SMILES:
CCc1n[nH]c(-c2c(Cl)csc2N)n1Molecular Processing
Molecular formula
C8H9ClN4S
Molecular weight
228.71
Exact mass
228.0236
XLogP
2.33
TPSA
67.59
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
58.5
Supplementary Information
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