Name: 6,6-dimethyl-11-oxo-8-(2-phenyl-[1,3]dioxan-5-yloxy)-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
SMILES:
CC1(C)c2cc(OC3COC(c4ccccc4)OC3)ccc2C(=O)c2c1[nH]c1cc(C#N)ccc21Molecular Processing
Molecular formula
C29H24N2O4
Molecular weight
464.52
Exact mass
464.1736
XLogP
5.4
TPSA
84.34
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
35
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
130.52
Supplementary Information
Details werden geladen…
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