Name: (S)-methyl 2-((S)-3-(benzyloxy)-2-((tert-butoxycarbonyl)amino) propanamido)-3-(4-methoxyphenyl)propanoate
SMILES:
COC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C26H34N2O7
Molecular weight
486.57
Exact mass
486.2366
XLogP
3.01
TPSA
112.19
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
35
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
129.9
Supplementary Information
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