2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(2-chlorophenyl)acetamide
Chemical Structure Depiction of
2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(2-chlorophenyl)acetamide
2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(2-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | G432-0130 |
| Compound Name: | 2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(2-chlorophenyl)acetamide |
| Molecular Weight: | 422.95 |
| Molecular Formula: | C18 H19 Cl N4 O2 S2 |
| Smiles: | CCCCC1=NN2C(=NC(CSCC(Nc3ccccc3[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.9699 |
| logD: | 3.9693 |
| logSw: | -4.1121 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.626 |
| InChI Key: | BEXPVYLBXFGVPB-UHFFFAOYSA-N |