CCCCc1ncc(C=N[C@@H](Cc2cccs2)C(=O)OC)n1Cc1ccccc1Cl
SMILES: CCCCc1ncc(C=N[C@@H](Cc2cccs2)C(=O)OC)n1Cc1ccccc1Cl

Molecular Processing

Molecular formula
C23H26ClN3O2S
Molecular weight
444
Exact mass
443.1434
XLogP
5.19
TPSA
56.48
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
122.81

Supplementary Information

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