CC(C)(C)OC(=O)NCC12CN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4-c3ccc(F)cc3F)CC1CCO2
Nombre: 7-[6a-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-3,3a,4,6-tetrahydro-2H-furo[2,3-c]pyrrol-5-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
SMILES: CC(C)(C)OC(=O)NCC12CN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4-c3ccc(F)cc3F)CC1CCO2

Molecular Processing

Molecular formula
C28H28F3N3O6
Molecular weight
559.54
Exact mass
559.193
XLogP
4.23
TPSA
110.1
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
40
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.393
Molar refractivity
139.62

Supplementary Information

InChIKey: FVVIXAURUWXNHG-UHFFFAOYSA-N
Sinónimos
SCHEMBL8924069FVVIXAURUWXNHG-UHFFFAOYSA-N7-(1-tert-butoxycarbonylaminomethyl-2-oxa-7-azabicyclo[3.3.0]oct-7-yl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid
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