Ethyl 2-{3-[(tert-butoxycarbonyl)amino]azetidin-1-yl)-4-n-butyl-1,3-thiazole-5-carboxylate

HCID 67548951
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCc1nc(N2CC(NC(=O)OC(C)(C)C)C2)sc1C(=O)OCC
InChIKey
GPIONGGIXYAQCJ-UHFFFAOYSA-N
Molecular formula
C18H29N3O4S
Average molar mass
383.5 g/mol

Names & identifiers

Preferred name
Ethyl 2-{3-[(tert-butoxycarbonyl)amino]azetidin-1-yl)-4-n-butyl-1,3-thiazole-5-carboxylate
IUPAC
ethyl 4-butyl-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]azetidin-1-yl]-1,3-thiazole-5-carboxylate

Names & synonyms

SCHEMBL2823182GPIONGGIXYAQCJ-UHFFFAOYSA-NEthyl 2-{3-[(tert-butoxycarbonyl)amino]azetidin-1-yl)-4-n-butyl-1,3-thiazole-5-carboxylate

Database identifiers

PubChem CID
67548951

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
109 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
10
Heavy atoms
26

Related reactions

3 records
New reaction record

Linked notes

Loading…