COC1=C(C=C(C=C1)C(CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O)OC4CCCC4
CAS: 192819-25-3
الاسم: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(1,3-dioxoisoindol-2-yl)propanoic acid
SMILES: COC1=C(C=C(C=C1)C(CC(=O)O)N2C(=O)C3=CC=CC=C3C2=O)OC4CCCC4

Molecular Processing

Molecular formula
C23H23NO6
Molecular weight
409.44
Exact mass
409.1525
XLogP
3.83
TPSA
93.14
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
107.81

Supplementary Information

InChIKey: OHOXTJAQCQVJEZ-UHFFFAOYSA-N
مرادفات
192819-25-3CHEMBL515728SCHEMBL4637167OHOXTJAQCQVJEZ-UHFFFAOYSA-N3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-phthalimidopropanoic acid3-(3-cyclopentyloxy-4-methoxyphenyl)-3-phthalimidopropanoic acid3-phthalimido-3-(3-cyclopentyloxy-4-methoxyphenyl)propionic acid3-(3-(cyclopentyloxy)-4-methoxyphenyl)-3-(1,3-dioxoisoindolin-2-yl)propanoic acid3-(3-(cyclopentyloxy)-4-methoxyphenyl)-3-(1,3-dioxoisoindolin-2-yl)propanoic acid?
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