7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)-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-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0149 |
| Compound Name: | 7-{[4-(furan-2-carbonyl)piperazin-1-yl]methyl}-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C22 H21 N5 O3 S |
| Smiles: | Cc1cccc(c1)C1=NN2C(=NC(CN3CCN(CC3)C(c3ccco3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.0726 |
| logD: | 2.0691 |
| logSw: | -2.5341 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.038 |
| InChI Key: | IUFNSPQJXPQOHD-UHFFFAOYSA-N |