SMILES:
CCc1[nH]c(C(=O)N[C@H]2CCN(c3nc(CC(=O)OC)c(C)s3)C[C@H]2OC)nc1ClMolecular Processing
Molecular formula
C19H26ClN5O4S
Molecular weight
455.97
Exact mass
455.1394
XLogP
2.13
TPSA
109.44
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
114.43
Supplementary Information
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Involved in 2 reactions→