Name: 2-((5S)-2-(2-(2-(piperidin-1-yl)ethylamino)-3-fluorophenyl)-3-(3,3-dimethylbutyl)-4-oxothiazolidin-5-yl)acetic acid
SMILES:
CC(C)(C)CCN1C(=O)[C@H](CC(=O)O)SC1c1cccc(F)c1NCCN1CCCCC1Molecular Processing
Molecular formula
C24H36FN3O3S
Molecular weight
465.64
Exact mass
465.2461
XLogP
4.58
TPSA
72.88
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
32
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
127.34
Supplementary Information
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