N-(3-chloro-2-methylphenyl)-4-[2-(furan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-4-[2-(furan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide
N-(3-chloro-2-methylphenyl)-4-[2-(furan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F525-0368 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-4-[2-(furan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide |
| Molecular Weight: | 470.94 |
| Molecular Formula: | C21 H19 Cl N6 O3 S |
| Smiles: | Cc1c(cccc1[Cl])NC(N1CCN(CC1)C1=CC(N2C(=N1)SC(c1ccco1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3748 |
| logD: | 3.374 |
| logSw: | -3.5809 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.526 |
| InChI Key: | VCNHITFQKZJLGJ-UHFFFAOYSA-N |