名称: [2,4-bis(phenylmethoxy)-5-propan-2-ylphenyl]-(5-hydroxy-1,3-dihydroisoindol-2-yl)methanone
SMILES:
CC(C)C1=CC(=C(C=C1OCC2=CC=CC=C2)OCC3=CC=CC=C3)C(=O)N4CC5=C(C4)C=C(C=C5)OMolecular Processing
Molecular formula
C32H31NO4
Molecular weight
493.6
Exact mass
493.2253
XLogP
6.83
TPSA
59
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.219
Molar refractivity
143.76
Supplementary Information
InChIKey: XLPDBLXQAHBLIV-UHFFFAOYSA-N
同義語
SCHEMBL382864XLPDBLXQAHBLIV-UHFFFAOYSA-N(2,4-Bis-benzyloxy-5-isopropyl-phenyl)-(5-hydroxy-1,3-dihydro-isoindol-2-yl)-methanone
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