CCC(CC)c1cc(C)nn2c(-c3sc4ccc(OC)cc4c3C)c(C)nc12
SMILES: CCC(CC)c1cc(C)nn2c(-c3sc4ccc(OC)cc4c3C)c(C)nc12

Molecular Processing

Molecular formula
C23H27N3OS
Molecular weight
393.56
Exact mass
393.1875
XLogP
6.45
TPSA
39.42
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
117.89

Supplementary Information

Details werden geladen…

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