CCc1nc(-c2ccc(OC)cc2OC)c(CC)nc1NC1c2ccccc2CC1O
SMILES: CCc1nc(-c2ccc(OC)cc2OC)c(CC)nc1NC1c2ccccc2CC1O

Molecular Processing

Molecular formula
C25H29N3O3
Molecular weight
419.53
Exact mass
419.2209
XLogP
4.36
TPSA
76.5
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
121.84

Supplementary Information

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