(2S)-2-(2-chloro-6-methyl-benzoylamino)-3-[4-(4-methyl-1,3-dioxo-1,3-dihydroisoindole-2-yl)phenyl]propionic acid

HCID 68459783
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Basic information

Standard SMILES
Cc1cccc(Cl)c1C(=O)N[C@@H](Cc1ccc(N2C(=O)c3cccc(C)c3C2=O)cc1)C(=O)O
InChIKey
DLLVJKJJDLWKOQ-FQEVSTJZSA-N
Molecular formula
C26H21ClN2O5
Average molar mass
476.9 g/mol

Names & identifiers

Preferred name
(2S)-2-(2-chloro-6-methyl-benzoylamino)-3-[4-(4-methyl-1,3-dioxo-1,3-dihydroisoindole-2-yl)phenyl]propionic acid
IUPAC
(2S)-2-[(2-chloro-6-methylbenzoyl)amino]-3-[4-(4-methyl-1,3-dioxoisoindol-2-yl)phenyl]propanoic acid

Names & synonyms

SCHEMBL2965786DLLVJKJJDLWKOQ-FQEVSTJZSA-N(2S)-2-(2-chloro-6-methyl-benzoylamino)-3-[4-(4-methyl-1,3-dioxo-1,3-dihydroisoindole-2-yl)phenyl] Propionic Acid(2S)-2-(2-chloro-6-methyl-benzoylamino)-3-[4-(4-methyl-1,3-dioxo-1,3-dihydroisoindole-2-yl)phenyl]propionic acid

Database identifiers

PubChem CID
68459783

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
104 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
34

Related reactions

2 records
New reaction record

Compound notes

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