2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-[3-(pyrrolidin-1-yl)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-(pyrrolidin-1-yl)propyl]acetamide--hydrogen chloride (1/1)
2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C066-4629 |
| Compound Name: | 2-[3-(4-chlorophenyl)-4-oxo[1,2]oxazolo[5,4-d]pyrimidin-5(4H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 452.34 |
| Molecular Formula: | C20 H22 Cl N5 O3 |
| Salt: | HCl |
| Smiles: | C1CCN(C1)CCCNC(CN1C=Nc2c(C1=O)c(c1ccc(cc1)[Cl])no2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2791 |
| logD: | -1.8114 |
| logSw: | -3.1787 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.363 |
| InChI Key: | QFOKWQPIVHTYIJ-UHFFFAOYSA-N |