CC(C)(C)OC(=O)N1CCCn2c(nc3cnc4cc(OCc5ccccc5)ccc4c32)C1
SMILES: CC(C)(C)OC(=O)N1CCCn2c(nc3cnc4cc(OCc5ccccc5)ccc4c32)C1

Molecular Processing

Molecular formula
C26H28N4O3
Molecular weight
444.54
Exact mass
444.2161
XLogP
5.3
TPSA
69.48
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
127.07

Supplementary Information

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