Name: (S)-2-amino-3-phenyl-N-(5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl)propanamide
SMILES:
N[C@@H](Cc1ccccc1)C(=O)Nc1nnc(-c2ccncc2)s1Molecular Processing
Molecular formula
C16H15N5OS
Molecular weight
325.4
Exact mass
325.0997
XLogP
2.11
TPSA
93.79
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
89.89
Supplementary Information
Details werden geladen…
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