CCOC(=O)CCc1ccc(C#N)cc1OCCNC(=O)C1CCN(c2ccnc(Cl)n2)CC1
SMILES: CCOC(=O)CCc1ccc(C#N)cc1OCCNC(=O)C1CCN(c2ccnc(Cl)n2)CC1

Molecular Processing

Molecular formula
C24H28ClN5O4
Molecular weight
485.97
Exact mass
485.183
XLogP
2.91
TPSA
117.44
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
34
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
126.59

Supplementary Information

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