(R)-3-{4-[(4-tert-butylphenylamino)methyl]benzoylamino}-2-hydroxypropionic acid

HCID 69733516
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Basic information

Standard SMILES
CC(C)(C)c1ccc(NCc2ccc(C(=O)NC[C@@H](O)C(=O)O)cc2)cc1
InChIKey
CSKRXGRFGWSRCR-GOSISDBHSA-N
Molecular formula
C21H26N2O4
Average molar mass
370.4 g/mol

Names & identifiers

Preferred name
(R)-3-{4-[(4-tert-butylphenylamino)methyl]benzoylamino}-2-hydroxypropionic acid
IUPAC
(2R)-3-[[4-[(4-tert-butylanilino)methyl]benzoyl]amino]-2-hydroxypropanoic acid

Names & synonyms

SCHEMBL6289554CSKRXGRFGWSRCR-GOSISDBHSA-N(R)-3-{4-[(4-tert-butylphenylamino)methyl]benzoylamino}-2-hydroxypropionic acid

Database identifiers

PubChem CID
69733516

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
98.7 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
27

Related reactions

2 records
New reaction record

Compound notes

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