Nom: methyl 2-(8-(benzo[d]thiazol-2-ylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-5-(3-hydroxypropyl)thiazole-4-carboxylate
SMILES:
COC(=O)c1nc(N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)sc1CCCOMolecular Processing
Molecular formula
C25H24N4O4S2
Molecular weight
508.63
Exact mass
508.1239
XLogP
4.28
TPSA
104.65
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
137.63
Supplementary Information
Récupération des détails…
Impliqué dans 5 réactions→