Basic information
- CAS
55242-77-8- Standard SMILES
c1ccc(Cc2nnc3ccncc3n2)cc1- InChIKey
ROINDGIBYTXRFE-UHFFFAOYSA-N- Molecular formula
- C13H10N4
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.09054634
Overview
Triafungin is a small molecule drug. The usage of the INN stem '-fungin' in the name indicates that Triafungin is a antifungal antibiotic. Triafungin has a monoisotopic molecular weight of 222.09 Da.
Names & identifiers
- Preferred name
- Triafungin
- IUPAC
- 3-benzylpyrido[3,4-e][1,2,4]triazine
- English name
- Triafungin
- Molecular formula
- C13H10N4
- Molecular weight
- 222.25
Names & synonyms
TRIAFUNGIN55242-77-83-benzylpyrido[3,4-e][1,2,4]triazineEU-3325Triafungin [USAN:INN]UNII-E51A927SNRE51A927SNR3-Benzylpyrido(3,4-c)-as-triazinePyrido(3,4-e)-1,2,4-triazine, 3-(phenylmethyl)-3-Benzylpyrido[3,4-c]-as-triazineTriafunginaTriafungine
Show more names
Pyrido[3,4-e]-1,2,4-triazine, 3-(phenylmethyl)-
TRIAFUNGIN [INN]Triafungin (USAN/INN)TRIAFUNGIN [USAN]orb2814764CHEMBL2107704SCHEMBL29362350DTXSID80203754NS00125066
Database identifiers
- CAS
55242-77-8- PubChem CID
- 41370
- DTXSID
DTXSID80203754- ChEMBL
CHEMBL2107704- UNII
- E51A927SNR
- Nikkaji
- J11.448K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- FDA UNII
- 51 A927SNR · E51A927SNR
Chemistry & industry
Suppliers2 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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