Basic information
- CAS
849130-29-6- Standard SMILES
CCOc1ccc(NC(=O)COc2ccc(-n3cnnn3)cc2)cc1- InChIKey
ASITUJNYBBYWNA-UHFFFAOYSA-N- Molecular formula
- C17H17N5O3
- Average molar mass
- 339.3 g/mol
- Monoisotopic mass
- 339.13313942
Names & identifiers
- Preferred name
- N-(4-ethoxyphenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
- IUPAC
- N-(4-ethoxyphenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
Names & synonyms
N-(4-ethoxyphenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamideMLS002163866CHEMBL1592893DTXSID501323674HMS3049I05AKOS001131601849130-29-6SMR001246248AB00741446-01Z25182050N-(4-Ethoxyphenyl)-2-[4-(1H-tetrazol-1-yl)phenoxy]acetamide
Database identifiers
- CAS
849130-29-6- PubChem CID
- 2709045
- DTXSID
DTXSID501323674- ChEMBL
CHEMBL1592893
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 91.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 409
Experimental & physicochemical properties
Solubility2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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