2-(thiophen-2-yl)-7-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(thiophen-2-yl)-7-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(thiophen-2-yl)-7-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0829 |
| Compound Name: | 2-(thiophen-2-yl)-7-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 527.62 |
| Molecular Formula: | C24 H25 N5 O5 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1cccs1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8625 |
| logD: | 1.8588 |
| logSw: | -2.6659 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.456 |
| InChI Key: | VYHUSIQLVZPFDK-UHFFFAOYSA-N |