N-(3-chloro-4-methylphenyl)-3-ethyl-6-(4-ethylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-ethyl-6-(4-ethylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-(3-chloro-4-methylphenyl)-3-ethyl-6-(4-ethylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | D137-0269 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-ethyl-6-(4-ethylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 441.98 |
| Molecular Formula: | C22 H24 Cl N5 O S |
| Smiles: | CCc1ccc(cc1)C1C(C(Nc2ccc(C)c(c2)[Cl])=O)Sc2nnc(CC)n2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5521 |
| logD: | 5.5498 |
| logSw: | -6.0731 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.031 |
| InChI Key: | ICDSDOBZBRGIJJ-UHFFFAOYSA-N |