CN1OC(CNc2ccccc2)CC1(Cn1ccnc1)c1ccc(Cl)cc1
SMILES: CN1OC(CNc2ccccc2)CC1(Cn1ccnc1)c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C21H23ClN4O
Molecular weight
382.9
Exact mass
382.156
XLogP
4.18
TPSA
42.32
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
107.54

Supplementary Information

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