3-tert-Butoxycarbonylamino-5-(1-hydroxy-cyclohexyl)-thiophene-2-carboxylic acid methyl ester

HCID 57795388
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Basic information

Standard SMILES
COC(=O)c1sc(C2(O)CCCCC2)cc1NC(=O)OC(C)(C)C
InChIKey
RDMQJIFPUUUVAS-UHFFFAOYSA-N
Molecular formula
C17H25NO5S
Average molar mass
355.5 g/mol
Monoisotopic mass
355.14534407

Names & identifiers

Preferred name
3-tert-Butoxycarbonylamino-5-(1-hydroxy-cyclohexyl)-thiophene-2-carboxylic acid methyl ester
IUPAC
methyl 5-(1-hydroxycyclohexyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylate

Names & synonyms

SCHEMBL2106086RDMQJIFPUUUVAS-UHFFFAOYSA-N3-tert-Butoxycarbonylamino-5-(1-hydroxy-cyclohexyl)-thiophene-2-carboxylic acid methyl ester

Database identifiers

PubChem CID
57795388

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
113 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
24

Related reactions

7 records
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Compound notes

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