CN(C)C(=O)Oc1cccc2c1CC[C@H]1[C@@H]2CCN1CCCCCN1C(=O)CC(C)(C)CC1=O.Cl
SMILES: CN(C)C(=O)Oc1cccc2c1CC[C@H]1[C@@H]2CCN1CCCCCN1C(=O)CC(C)(C)CC1=O.Cl

Molecular Processing

Molecular formula
C27H40ClN3O4
Molecular weight
506.09
Exact mass
505.2707
XLogP
4.62
TPSA
70.16
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
35
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.667
Molar refractivity
138.03

Supplementary Information

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