O=C(CCCc1cccs1)NNC(=O)N1Cc2ccccc2Oc2ccc(Cl)cc21
SMILES: O=C(CCCc1cccs1)NNC(=O)N1Cc2ccccc2Oc2ccc(Cl)cc21

Molecular Processing

Molecular formula
C22H20ClN3O3S
Molecular weight
441.94
Exact mass
441.0914
XLogP
5.28
TPSA
70.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
118.08

Supplementary Information

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