Basic information
- Standard SMILES
Cc1nc(-c2ccc(CN)c(NCC(=O)OCc3ccccc3)c2)no1.Cl- InChIKey
QDJUBZNVBJRQLN-UHFFFAOYSA-N- Molecular formula
- C19H21ClN4O3
- Average molar mass
- 388.8 g/mol
- Monoisotopic mass
- 388.1302182
Names & identifiers
- Preferred name
- Benzyl 2-(2-(aminomethyl)-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenylamino)acetate hydrochloride
- IUPAC
- benzyl 2-[2-(aminomethyl)-5-(5-methyl-1,2,4-oxadiazol-3-yl)anilino]acetate;hydrochloride
Names & synonyms
SCHEMBL5565492QDJUBZNVBJRQLN-UHFFFAOYSA-NBenzyl 2-(2-(aminomethyl)-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenylamino)acetate hydrochloride
Database identifiers
- PubChem CID
- 69490392
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 445
Related reactions
10 records
Compound notes
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