CCN(CC)C/C=C\c1cc(F)ccc1S(=O)(=O)Cc1ccc2c(c1C(=O)OC)OC[C@@H]1C[C@H]21
Nombre: methyl cis-(1aRS,7bSR)-5-[2-((Z)-3-diethylaminoprop-1-enyl)-4-fluoro-benzenesulfonylmethyl]-1,1a,2,7b-tetrahydrocyclopropa[c]chromene-4-carboxylate
SMILES: CCN(CC)C/C=C\c1cc(F)ccc1S(=O)(=O)Cc1ccc2c(c1C(=O)OC)OC[C@@H]1C[C@H]21

Molecular Processing

Molecular formula
C26H30FNO5S
Molecular weight
487.59
Exact mass
487.1829
XLogP
4.44
TPSA
72.91
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
128.24

Supplementary Information

Obteniendo detalles…

Participa en 2 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→