ethyl 4-{[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl}piperazine-1-carboxylate
ethyl 4-{[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | G856-3741 |
| Compound Name: | ethyl 4-{[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetyl}piperazine-1-carboxylate |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C14 H18 N6 O4 S2 |
| Smiles: | CCOC(N1CCN(CC1)C(CSC1=NN2C(=NN=C(C)C2=O)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3709 |
| logD: | 1.1098 |
| logSw: | -1.497 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.862 |
| InChI Key: | VTOLOHGKGJDFKY-UHFFFAOYSA-N |