6-(3-chloro-4-methoxyphenyl)-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-(3-chloro-4-methoxyphenyl)-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-(3-chloro-4-methoxyphenyl)-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: | 7238-1941 |
| Compound Name: | 6-(3-chloro-4-methoxyphenyl)-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: | 485.99 |
| Molecular Formula: | C23 H24 Cl N5 O3 S |
| Smiles: | COc1ccc(cc1[Cl])C1C(C(NCC2CCCO2)=O)Sc2nnc(c3ccccc3)n2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3986 |
| logD: | 3.3986 |
| logSw: | -4.0416 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.39 |
| InChI Key: | QNYHWSZUPKZAQA-UHFFFAOYSA-N |