Nombre: 4-(2-Chloro-6-methoxyphenyl)-6-(3-hydroxypropyl)-9-methoxypyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione
SMILES:
COc1ccc2c(c1)c1c3c(c(-c4c(Cl)cccc4OC)cc1n2CCCO)C(=O)NC3=OMolecular Processing
Molecular formula
C25H21ClN2O5
Molecular weight
464.91
Exact mass
464.1139
XLogP
4.4
TPSA
89.79
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
126.49
Supplementary Information
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