6-(3-bromophenyl)-7-(2-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Basic information
- CAS
698382-10-4- Standard SMILES
Fc1ccccc1C1C2=C(Nc3ncnn31)c1ccccc1OC2c1cccc(Br)c1- InChIKey
PZLAQUPOYSUPAB-UHFFFAOYSA-N- Molecular formula
- C24H16BrFN4O
- Average molar mass
- 475.3 g/mol
- Monoisotopic mass
- 474.04915
Names & identifiers
- Preferred name
- 6-(3-bromophenyl)-7-(2-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
- IUPAC
- 9-(3-bromophenyl)-11-(2-fluorophenyl)-8-oxa-12,13,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,15-hexaene
- English name
- 6-(3-bromophenyl)-7-(2-fluorophenyl)-7,9-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
- Molecular formula
- C24H16BrFN4O
- Molecular weight
- 475.31
Names & synonyms
6-(3-bromophenyl)-7-(2-fluorophenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidineSTK999557AKOS002140617AKOS021706981EU-00655476-(3-bromophenyl)-7-(2-fluorophenyl)-7,12-dihydro-6H-[1]benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine6-(3-bromophenyl)-7-(2-fluorophenyl)-7,9-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine6H-[1]Benzopyrano[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine, 6-(3-bromophenyl)-7-(2-fluorophenyl)-7,9-dihydro-
Database identifiers
- CAS
698382-10-4- PubChem CID
- 3799809
- EC Number
- 133-967-3
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 707
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…