O=C(O)c1cc(Cl)cnc1N1CC(O)(c2ccc(F)cc2)C1
الاسم: 5-chloro-2-(3-(4-fluorophenyl)-3-hydroxyazetidin-1-yl)nicotinic acid
SMILES: O=C(O)c1cc(Cl)cnc1N1CC(O)(c2ccc(F)cc2)C1

Molecular Processing

Molecular formula
C15H12ClFN2O3
Molecular weight
322.72
Exact mass
322.052
XLogP
2.28
TPSA
73.66
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
78.72

Supplementary Information

جارٍ جلب التفاصيل…

مشارك في 1 تفاعل