O=C1O[C@@H](Cn2nnc(-c3cccnc3)n2)[C@H](c2cccc(O)c2)N1c1ccc(Cl)cc1
Name: (4S,5S)-3-(4-chlorophenyl)-4-(3-hydroxyphenyl)-5-((5-(pyridin-3-yl)-2H-tetrazol-2-yl)-methyl)oxazolidin-2-one
SMILES: O=C1O[C@@H](Cn2nnc(-c3cccnc3)n2)[C@H](c2cccc(O)c2)N1c1ccc(Cl)cc1

Molecular Processing

Molecular formula
C22H17ClN6O3
Molecular weight
448.87
Exact mass
448.1051
XLogP
3.86
TPSA
106.26
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
116.1

Supplementary Information

Details werden geladen…

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