2-{[(Benzyloxy)carbonyl]amino}-3-(thiophen-2-yl)propanoic acid

HCID 12806830

Basic information

Standard SMILES
O=C(NC(Cc1cccs1)C(=O)O)OCc1ccccc1
InChIKey
CKJLJMFZZAWDKK-UHFFFAOYSA-N
Molecular formula
C15H15NO4S
Average molar mass
305.4 g/mol

Names & identifiers

Preferred name
2-{[(Benzyloxy)carbonyl]amino}-3-(thiophen-2-yl)propanoic acid
IUPAC
2-(phenylmethoxycarbonylamino)-3-thiophen-2-ylpropanoic acid

Names & synonyms

86394-48-12-{[(benzyloxy)carbonyl]amino}-3-(thiophen-2-yl)propanoic acid2-(((Benzyloxy)carbonyl)amino)-3-(thiophen-2-yl)propanoic acidSCHEMBL2961792CKJLJMFZZAWDKK-UHFFFAOYSA-NAKOS013464854DB-209722N-(Benzyloxycarbonyl) beta-thienyl-D,L-alanineEN300-1229296N-(benzyloxycarbonyl)-3-(2-thienyl)-dl-alanineN-(Benzyloxycarbonyl)-3-(2-thienyl)-D,L-alanine

Database identifiers

PubChem CID
12806830

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
104 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
21

Related reactions

33 records

Linked notes

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