Name: 5-Benzyl-hexahydro-pyrrolo[3,4-c]pyrrole-2-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1CC2CN(Cc3ccccc3)CC2C1Molecular Processing
Molecular formula
C18H26N2O2
Molecular weight
302.42
Exact mass
302.1994
XLogP
2.99
TPSA
32.78
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
86.51
Supplementary Information
Details werden geladen…
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