3-phenyldibenzo[b,f][1,2,4]triazolo[4,3-d][1,4]oxazepine-6,7-dicarbonitrile
Chemical Structure Depiction of
3-phenyldibenzo[b,f][1,2,4]triazolo[4,3-d][1,4]oxazepine-6,7-dicarbonitrile
3-phenyldibenzo[b,f][1,2,4]triazolo[4,3-d][1,4]oxazepine-6,7-dicarbonitrile
Compound characteristics
| Compound ID: | 5849-2324 |
| Compound Name: | 3-phenyldibenzo[b,f][1,2,4]triazolo[4,3-d][1,4]oxazepine-6,7-dicarbonitrile |
| Molecular Weight: | 361.36 |
| Molecular Formula: | C22 H11 N5 O |
| Smiles: | C(c1cc2c(cc1C#N)Oc1ccccc1c1nnc(c3ccccc3)n12)#N |
| Stereo: | ACHIRAL |
| logP: | 4.0191 |
| logD: | 4.0191 |
| logSw: | -4.4194 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 65.255 |
| InChI Key: | UALAFHQBMJKWIW-UHFFFAOYSA-N |