Название: 1-(N-t-butoxycarbonyl-2(S)-aminobutyryl)-5-benzyloxyindoline-2-(R/S)-carboxylic acid
SMILES:
CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1c2ccc(OCc3ccccc3)cc2CC1C(=O)OMolecular Processing
Molecular formula
C25H30N2O6
Molecular weight
454.52
Exact mass
454.2104
XLogP
3.91
TPSA
105.17
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
123.28
Supplementary Information
Загрузка подробностей…
Участвует в 3 реакциях→