N-(2-ethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-(2-ethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | D137-0650 |
| Compound Name: | N-(2-ethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C26 H24 F N5 O2 S |
| Smiles: | CCc1ccccc1NC(C1C(c2ccc(cc2)F)Nn2c(COc3ccccc3)nnc2S1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8543 |
| logD: | 4.8543 |
| logSw: | -4.4919 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.561 |
| InChI Key: | NJOIIXRPZHGZEE-UHFFFAOYSA-N |