SMILES:
Cc1cc2c(s1)Nc1ccccc1N=C2N1CCNC(CCc2ccc(Cl)cc2)C1Molecular Processing
Molecular formula
C24H25ClN4S
Molecular weight
437.01
Exact mass
436.1488
XLogP
5.75
TPSA
39.66
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.292
Molar refractivity
128.11
Supplementary Information
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