이름: tert-butyl 6-cyclohexyl-3-[3-[(pentan-3-ylamino)methyl]-1,2,4-oxadiazol-5-yl]hexanoate
SMILES:
CCC(CC)NCC1=NOC(=N1)C(CCCC2CCCCC2)CC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C24H43N3O3
Molecular weight
421.63
Exact mass
421.3304
XLogP
5.91
TPSA
77.25
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
12
Heavy atoms
30
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.875
Molar refractivity
119.14
Supplementary Information
InChIKey: RWOOXNHOVIHFIB-UHFFFAOYSA-N
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