2-(3-chlorophenyl)-7-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-7-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(3-chlorophenyl)-7-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0361 |
| Compound Name: | 2-(3-chlorophenyl)-7-{[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 471.99 |
| Molecular Formula: | C21 H18 Cl N5 O2 S2 |
| Smiles: | C1CN(CCN1CC1=CC(N2C(=N1)SC(c1cccc(c1)[Cl])=N2)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0839 |
| logD: | 3.0804 |
| logSw: | -3.4434 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.478 |
| InChI Key: | PSQHVKINEKSJRE-UHFFFAOYSA-N |