Nom: ethyl {2-[2-(10-methyl-5,5-dioxo-5,10-dihydrophenothiazin-2-yl)-3-(tetrahydropyran-4-yl)propionylamino]thiazol-4-yl}acetate
SMILES:
CCOC(=O)Cc1csc(NC(=O)C(CC2CCOCC2)c2ccc3c(c2)N(C)c2ccccc2S3(=O)=O)n1Molecular Processing
Molecular formula
C28H31N3O6S2
Molecular weight
569.71
Exact mass
569.1654
XLogP
4.7
TPSA
114.9
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
8
Heavy atoms
39
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.393
Molar refractivity
148.38
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→