이름: 6-chloro-N-[1-(2-chloro-phenyl)-2-(piperidin-4-ylmethoxy)ethyl]benzo[b]thiophene-2-carboxamide
SMILES:
O=C(NC(COCC1CCNCC1)c1ccccc1Cl)c1cc2ccc(Cl)cc2s1Molecular Processing
Molecular formula
C23H24Cl2N2O2S
Molecular weight
463.43
Exact mass
462.0936
XLogP
5.7
TPSA
50.36
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
124.91
Supplementary Information
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