3-bromophenyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
3-bromophenyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxylate
3-bromophenyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | D337-1271 |
| Compound Name: | 3-bromophenyl 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 402.2 |
| Molecular Formula: | C18 H12 Br N O5 |
| Smiles: | C1COc2cc(ccc2O1)c1cc(C(=O)Oc2cccc(c2)[Br])no1 |
| Stereo: | ACHIRAL |
| logP: | 3.6758 |
| logD: | 3.6758 |
| logSw: | -4.1286 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.975 |
| InChI Key: | ARIFCPVHXLHOBJ-UHFFFAOYSA-N |