Basic information
- Standard SMILES
COc1cc(CO)c(O)c(-n2nc3ccc(OC)cc3n2)c1- InChIKey
KEJWYCMPYSAJOA-UHFFFAOYSA-N- Molecular formula
- C15H15N3O4
- Average molar mass
- 301.3 g/mol
- Monoisotopic mass
- 301.10625597
Names & identifiers
- Preferred name
- 2-(hydroxymethyl)-4-methoxy-6-(5-methoxy-2H-benzo[d][1,2,3]triazol-2-yl)phenol
- IUPAC
- 2-(hydroxymethyl)-4-methoxy-6-(5-methoxybenzotriazol-2-yl)phenol
Names & synonyms
SCHEMBL1098570KEJWYCMPYSAJOA-UHFFFAOYSA-N2-(hydroxymethyl)-4-methoxy-6-(5-methoxy-2H-benzo[d][1,2,3]-triazol-2-yl)phenol2-(hydroxymethyl)-4-methoxy-6-(5-methoxy-2H-benzo[d][1,2,3]triazol-2-yl)phenol
Database identifiers
- PubChem CID
- 66906992
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 89.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 373
Related reactions
6 records
Compound notes
Loading…