CCOC(=O)c1sc(N2CC(N(C)C(=O)c3nc(Cl)c(CC)[nH]3)C2)nc1C
SMILES: CCOC(=O)c1sc(N2CC(N(C)C(=O)c3nc(Cl)c(CC)[nH]3)C2)nc1C

Molecular Processing

Molecular formula
C17H22ClN5O3S
Molecular weight
411.92
Exact mass
411.1132
XLogP
2.53
TPSA
91.42
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
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
0.529
Molar refractivity
103.88

Supplementary Information

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