O=C(Nc1ccc2cn[nH]c2c1)c1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1
SMILES: O=C(Nc1ccc2cn[nH]c2c1)c1cccc(N(Cc2ccccc2)S(=O)(=O)c2ccccc2)c1

Molecular Processing

Molecular formula
C27H22N4O3S
Molecular weight
482.57
Exact mass
482.1413
XLogP
5.21
TPSA
95.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
35
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.037
Molar refractivity
136.74

Supplementary Information

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