3-[(3,4-dimethoxyphenyl)methyl]-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
3-[(3,4-dimethoxyphenyl)methyl]-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-[(3,4-dimethoxyphenyl)methyl]-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | G786-0624 |
| Compound Name: | 3-[(3,4-dimethoxyphenyl)methyl]-6-(4-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 384.43 |
| Molecular Formula: | C19 H17 F N4 O2 S |
| Smiles: | COc1ccc(Cc2nnc3n2N=C(CS3)c2ccc(cc2)F)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.2751 |
| logD: | 3.2608 |
| logSw: | -3.3725 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.195 |
| InChI Key: | RVPGHQNQTSJIIT-UHFFFAOYSA-N |