N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide
N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | 8629-0100 |
| Compound Name: | N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-3,4-dimethoxybenzamide |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C18 H20 N4 O4 S |
| Smiles: | CCC(C)C1=NN2C(=NC=C(C2=O)NC(c2ccc(c(c2)OC)OC)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3138 |
| logD: | 1.9451 |
| logSw: | -3.0377 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.106 |
| InChI Key: | VICVMWDESMOFHR-JTQLQIEISA-N |