7-{4-[(4-chlorophenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{4-[(4-chlorophenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{4-[(4-chlorophenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0046 |
| Compound Name: | 7-{4-[(4-chlorophenoxy)acetyl]piperazin-1-yl}-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 481.96 |
| Molecular Formula: | C23 H20 Cl N5 O3 S |
| Smiles: | C1CN(CCN1C1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9829 |
| logD: | 2.9754 |
| logSw: | -3.4782 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.796 |
| InChI Key: | IRCJNCPFBCMADG-UHFFFAOYSA-N |