Name: phenylmethyl (S)-4-[4-[[(1,1-dimethylethoxy)carbonyl]amino]-5-(4-ethylpiperid-1-yl)-5-oxopentyl]piperidine-1-carboxylate
SMILES:
CCC1CCN(C(=O)[C@H](CCCC2CCN(C(=O)OCc3ccccc3)CC2)NC(=O)OC(C)(C)C)CC1Molecular Processing
Molecular formula
C30H47N3O5
Molecular weight
529.72
Exact mass
529.3516
XLogP
5.75
TPSA
88.18
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
38
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
147.53
Supplementary Information
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