Nom: ethyl 2-(6-(tert-butoxycarbonyl((1-(3-fluoropyridin-2-yl)cyclobutyl)methyl)amino)pyridazin-3-yl)thiazole-5-carboxylate
SMILES:
CCOC(=O)c1cnc(-c2ccc(N(CC3(c4ncccc4F)CCC3)C(=O)OC(C)(C)C)nn2)s1Molecular Processing
Molecular formula
C25H28FN5O4S
Molecular weight
513.6
Exact mass
513.1846
XLogP
5.17
TPSA
107.4
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
132.4
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→