6-(4-chlorophenyl)-N-[(oxolan-2-yl)methyl]-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
6-(4-chlorophenyl)-N-[(oxolan-2-yl)methyl]-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
6-(4-chlorophenyl)-N-[(oxolan-2-yl)methyl]-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | 7238-1621 |
| Compound Name: | 6-(4-chlorophenyl)-N-[(oxolan-2-yl)methyl]-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C22 H22 Cl N5 O2 S |
| Smiles: | C1CC(CNC(C2C(c3ccc(cc3)[Cl])Nn3c(c4ccccc4)nnc3S2)=O)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5201 |
| logD: | 3.5201 |
| logSw: | -4.265 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.759 |
| InChI Key: | LGAJRNWBNVQALQ-UHFFFAOYSA-N |