Methyl 3-({[3-(benzyloxy)-1-(hydroxymethyl)propyl]amino}carbonyl)benzoate

HCID 21086152
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Basic information

Standard SMILES
COC(=O)c1cccc(C(=O)NC(CO)CCOCc2ccccc2)c1
InChIKey
TYKLNBMWOQAZGW-UHFFFAOYSA-N
Molecular formula
C20H23NO5
Average molar mass
357.4 g/mol

Names & identifiers

Preferred name
Methyl 3-({[3-(benzyloxy)-1-(hydroxymethyl)propyl]amino}carbonyl)benzoate
IUPAC
methyl 3-[(1-hydroxy-4-phenylmethoxybutan-2-yl)carbamoyl]benzoate

Names & synonyms

SCHEMBL3350717TYKLNBMWOQAZGW-UHFFFAOYSA-NMethyl 3-({[3-(benzyloxy)-1-(hydroxymethyl)propyl]amino}carbonyl)benzoate

Database identifiers

PubChem CID
21086152

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
84.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
26

Related reactions

3 records
New reaction record

Compound notes

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