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4-Amino-1-(4-t-butylbenzyl)-5-imidazolecarboxamide hydrochloride

HCID 18360288
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Basic information

Standard SMILES
CC(C)(C)c1ccc(Cn2cnc(N)c2C(N)=O)cc1.Cl
InChIKey
TWXPNMWLHIUYSY-UHFFFAOYSA-N
Molecular formula
C15H21ClN4O
Average molar mass
308.8 g/mol

Names & identifiers

Preferred name
4-Amino-1-(4-t-butylbenzyl)-5-imidazolecarboxamide hydrochloride
IUPAC
5-amino-3-[(4-tert-butylphenyl)methyl]imidazole-4-carboxamide;hydrochloride

Names & synonyms

SCHEMBL7984673TWXPNMWLHIUYSY-UHFFFAOYSA-N4-amino-1-(4-t-butylbenzyl)-5-imidazolecarboxamide hydrochloride

Database identifiers

PubChem CID
18360288

Properties

Computed structural properties

Topological polar surface area
86.9 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
344

Related reactions

1 records
New reaction record
HRID 382430 reaction equation
HRID 382430As reactantuspto-grants-2001_10

Compound notes

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