CAS: 1323407-16-4
이름: methyl 5-amino-4-(7-hydroxy-3-oxo-1H-isoindol-2-yl)-5-oxopentanoate
SMILES:
COC(=O)CCC(C(=O)N)N1CC2=C(C1=O)C=CC=C2OMolecular Processing
Molecular formula
C14H16N2O5
Molecular weight
292.29
Exact mass
292.1059
XLogP
0.16
TPSA
109.93
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
72.21
Supplementary Information
InChIKey: STDQXJRROFVUBT-UHFFFAOYSA-N
동의어
1323407-16-4methyl 5-amino-4-(4-hydroxy-1-oxoisoindolin-2-yl)-5-oxopentanoateSCHEMBL2248688SCHEMBL29471925STDQXJRROFVUBT-UHFFFAOYSA-NDA-460444-carbamoyl-4-(4-hydroxy-1-oxo-1,3-dihydro-isoindol-2-yl)-butyric acid methyl ester
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