2-phenyl-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-phenyl-7-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-phenyl-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: | G768-0048 |
| Compound Name: | 2-phenyl-7-{[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 521.59 |
| Molecular Formula: | C26 H27 N5 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9205 |
| logD: | 1.9168 |
| logSw: | -2.7981 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.437 |
| InChI Key: | ZYXKCBJUGXJCBR-UHFFFAOYSA-N |