4-({Acetyl[(1-methyl-1H-1,2,3-triazol-4-yl)methyl]amino}methyl)benzoic acid

HCID 59627282
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Basic information

Standard SMILES
CC(=O)N(Cc1ccc(C(=O)O)cc1)Cc1cn(C)nn1
InChIKey
YZUZDLSPZOHFBM-UHFFFAOYSA-N
Molecular formula
C14H16N4O3
Average molar mass
288.3 g/mol

Names & identifiers

Preferred name
4-({Acetyl[(1-methyl-1H-1,2,3-triazol-4-yl)methyl]amino}methyl)benzoic acid
IUPAC
4-[[acetyl-[(1-methyltriazol-4-yl)methyl]amino]methyl]benzoic acid

Names & synonyms

SCHEMBL3678461YZUZDLSPZOHFBM-UHFFFAOYSA-N4-({Acetyl[(1-methyl-1H-1,2,3-triazol-4-yl)methyl]amino}methyl)benzoic acid

Database identifiers

PubChem CID
59627282

Properties

Computed structural properties

XLogP
0
Topological polar surface area
88.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21

Related reactions

4 records
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Compound notes

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