(S)-2-(2-(1H-1,2,4-triazol-1-yl)acetamido)-3-(benzyloxy)-N-(4-phenoxyphenyl)propanamide

HCID 67009192
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Basic information

Standard SMILES
O=C(Cn1cncn1)N[C@@H](COCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2)cc1
InChIKey
FVJOPKFMBHHZJJ-DEOSSOPVSA-N
Molecular formula
C26H25N5O4
Average molar mass
471.5 g/mol

Names & identifiers

Preferred name
(S)-2-(2-(1H-1,2,4-triazol-1-yl)acetamido)-3-(benzyloxy)-N-(4-phenoxyphenyl)propanamide
IUPAC
(2S)-N-(4-phenoxyphenyl)-3-phenylmethoxy-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]propanamide

Names & synonyms

SCHEMBL1371785FVJOPKFMBHHZJJ-DEOSSOPVSA-N(S)-2-(2-(1H-1,2,4-triazol-1-yl)acetamido)-3-(benzyloxy)-N-(4-phenoxyphenyl)propanamide

Database identifiers

PubChem CID
67009192

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
35

Related reactions

1 records
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Compound notes

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