7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(4-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(4-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(4-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0930 |
| Compound Name: | 7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(4-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C22 H21 N5 O4 S |
| Smiles: | COc1ccc(cc1)C1=NN2C(=NC(CN3CCN(CC3)C(c3ccco3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.7098 |
| logD: | 1.7062 |
| logSw: | -2.3139 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.582 |
| InChI Key: | AJOHOSXXSLUWLM-UHFFFAOYSA-N |