{N-[(1R)-1-Carbamoyl-3-methyl-butyl]-N-(4-chlorobenzenesulfonyl)amino}acetic acid

HCID 59001083

Basic information

Standard SMILES
CC(C)C[C@H](C(N)=O)N(CC(=O)O)S(=O)(=O)c1ccc(Cl)cc1
InChIKey
BFFDDERCXVNLNR-GFCCVEGCSA-N
Molecular formula
C14H19ClN2O5S
Average molar mass
362.8 g/mol

Names & identifiers

Preferred name
{N-[(1R)-1-Carbamoyl-3-methyl-butyl]-N-(4-chlorobenzenesulfonyl)amino}acetic acid
IUPAC
2-[[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]-(4-chlorophenyl)sulfonylamino]acetic acid

Names & synonyms

SCHEMBL1875811BFFDDERCXVNLNR-GFCCVEGCSA-N{N-[(1R)-1-Carbamoyl-3-methyl-butyl]-N-(4-chlorobenzenesulfonyl)amino}acetic acid{N-[(IR)-1-Carbamoyl-3-methyl-butyl]-N-(4-chlorobenzenesulfonyl)amino}acetic acid

Database identifiers

PubChem CID
59001083

Properties

Computed structural properties

XLogP
2
Topological polar surface area
126 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
23

Related reactions

6 records

Compound notes

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