Name: Intermediate 2
SMILES:
CC(C)C[C@H](C(=O)N1CCN(c2nc(-c3ccccc3)ns2)CC1)[C@H](O)C(=O)NOMolecular Processing
Molecular formula
C20H27N5O4S
Molecular weight
433.53
Exact mass
433.1784
XLogP
1.38
TPSA
118.89
H-bond donors
3
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
10
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
113.02
Supplementary Information
Details werden geladen…
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