6-benzyl-3-(4-bromobenzoyl)[1,2]oxazolo[4,3-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
6-benzyl-3-(4-bromobenzoyl)[1,2]oxazolo[4,3-d]pyrimidin-7(6H)-one
6-benzyl-3-(4-bromobenzoyl)[1,2]oxazolo[4,3-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 8016-1450 |
| Compound Name: | 6-benzyl-3-(4-bromobenzoyl)[1,2]oxazolo[4,3-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 410.22 |
| Molecular Formula: | C19 H12 Br N3 O3 |
| Smiles: | C(c1ccccc1)N1C=Nc2c(C1=O)noc2C(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.394 |
| logD: | 3.394 |
| logSw: | -3.5837 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.455 |
| InChI Key: | KLSMAGWTGQKAQG-UHFFFAOYSA-N |