2-(3-fluorophenyl)-7-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(3-fluorophenyl)-7-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(3-fluorophenyl)-7-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0612 |
| Compound Name: | 2-(3-fluorophenyl)-7-{[4-(3-methoxybenzoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 479.53 |
| Molecular Formula: | C24 H22 F N5 O3 S |
| Smiles: | COc1cccc(c1)C(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1cccc(c1)F)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3855 |
| logD: | 2.3819 |
| logSw: | -2.7354 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.003 |
| InChI Key: | HLWSLAPHVBTHFV-UHFFFAOYSA-N |