3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-[(2-chloro-4-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-[(2-chloro-4-fluorophenyl)methyl]propanamide
3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-[(2-chloro-4-fluorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | L553-1708 |
| Compound Name: | 3-[4-(azepan-1-yl)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin-6-yl]-N-[(2-chloro-4-fluorophenyl)methyl]propanamide |
| Molecular Weight: | 445.92 |
| Molecular Formula: | C22 H25 Cl F N5 O2 |
| Smiles: | Cc1c2c(nc(CCC(NCc3ccc(cc3[Cl])F)=O)nc2on1)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7518 |
| logD: | 4.75 |
| logSw: | -4.8916 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.895 |
| InChI Key: | QXGXJDHZABHURN-UHFFFAOYSA-N |