Name: (R)-3-[(2S,3S)-2-hydroxy-3-(3-hydroxy-2-methyl-benzoylamino)-4-phenyl-butyryl]-5,5-dimethyl-thiazolidine-4-carboxylic acid allylamide
SMILES:
C=CCNC(=O)[C@H]1N(C(=O)[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cccc(O)c2C)CSC1(C)CMolecular Processing
Molecular formula
C27H33N3O5S
Molecular weight
511.64
Exact mass
511.2141
XLogP
2.38
TPSA
118.97
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.37
Molar refractivity
140.63
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→