CCc1cc(OC)c(F)c(C(Nc2ccc3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nccc3c2)c2nc(Br)cn2C(c2ccccc2)(c2ccccc2)c2ccccc2)c1
Name: Intermediate 206.4
SMILES: CCc1cc(OC)c(F)c(C(Nc2ccc3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nccc3c2)c2nc(Br)cn2C(c2ccccc2)(c2ccccc2)c2ccccc2)c1

Molecular Processing

Molecular formula
C51H51BrFN5O5
Molecular weight
912.9
Exact mass
911.3058
XLogP
12.62
TPSA
107.81
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
11
Heavy atoms
63
Rings
7
Aromatic rings
7
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.255
Molar refractivity
249.02

Supplementary Information

Details werden geladen…

An 6 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→