2-(4-chlorophenyl)-7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(4-chlorophenyl)-7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0433 |
| Compound Name: | 2-(4-chlorophenyl)-7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C21 H18 Cl N5 O3 S |
| Smiles: | C1CN(CCN1CC1=CC(N2C(=N1)SC(c1ccc(cc1)[Cl])=N2)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3221 |
| logD: | 2.3186 |
| logSw: | -3.0241 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.038 |
| InChI Key: | YGRVKHVBAATWGT-UHFFFAOYSA-N |