5-(2,3-dihydro-1H-inden-5-yl)-1-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
5-(2,3-dihydro-1H-inden-5-yl)-1-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
5-(2,3-dihydro-1H-inden-5-yl)-1-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | L109-0503 |
| Compound Name: | 5-(2,3-dihydro-1H-inden-5-yl)-1-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione |
| Molecular Weight: | 400.36 |
| Molecular Formula: | C20 H15 F3 N4 O2 |
| Smiles: | C1Cc2ccc(cc2C1)N1C(C2C(C1=O)N(c1cccc(c1)C(F)(F)F)N=N2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6239 |
| logD: | 3.6237 |
| logSw: | -3.7979 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.24 |
| InChI Key: | HMUMZTSLUJAYLT-UHFFFAOYSA-N |