3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide
Chemical Structure Depiction of
3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide
3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide
Compound characteristics
| Compound ID: | L553-1695 |
| Compound Name: | 3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-(3-bromophenyl)propanamide |
| Molecular Weight: | 458.36 |
| Molecular Formula: | C21 H24 Br N5 O2 |
| Smiles: | Cc1c2c(nc(CCC(Nc3cccc(c3)[Br])=O)nc2on1)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.8367 |
| logD: | 4.8363 |
| logSw: | -4.7627 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.573 |
| InChI Key: | PLPBRBXFMZYVOO-UHFFFAOYSA-N |