2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{3-[ethyl(phenyl)amino]propyl}acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{3-[ethyl(phenyl)amino]propyl}acetamide--hydrogen chloride (1/1)
2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{3-[ethyl(phenyl)amino]propyl}acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C066-4605 |
| Compound Name: | 2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-{3-[ethyl(phenyl)amino]propyl}acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 502.4 |
| Molecular Formula: | C24 H24 Cl N5 O3 |
| Salt: | HCl |
| Smiles: | CCN(CCCNC(CN1C=Nc2c(C1=O)c(c1ccc(cc1)[Cl])no2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0472 |
| logD: | 3.018 |
| logSw: | -3.9394 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.005 |
| InChI Key: | BACOYHBGPXQTQZ-UHFFFAOYSA-N |