8-bromo-9-hydroxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Chemical Structure Depiction of
8-bromo-9-hydroxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
8-bromo-9-hydroxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | 8018-3345 |
| Compound Name: | 8-bromo-9-hydroxy-1,2,3,4-tetrahydro-5H-[1]benzopyrano[3,4-b]pyridin-5-one |
| Molecular Weight: | 296.12 |
| Molecular Formula: | C12 H10 Br N O3 |
| Smiles: | C1CC2=C(C(=O)Oc3cc(c(cc23)O)[Br])NC1 |
| Stereo: | ACHIRAL |
| logP: | 2.2509 |
| logD: | 1.8768 |
| logSw: | -2.6018 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.124 |
| InChI Key: | XBECSVMOIGGWJM-UHFFFAOYSA-N |