2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(4-methoxyphenyl)acetamide
2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G432-0135 |
| Compound Name: | 2-{[(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C19 H22 N4 O3 S2 |
| Smiles: | CCCCC1=NN2C(=NC(CSCC(Nc3ccc(cc3)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.9015 |
| logD: | 3.9011 |
| logSw: | -4.0381 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.867 |
| InChI Key: | AQSDDINQIHRVJB-UHFFFAOYSA-N |