N-(2-chlorophenyl)-6-(4-fluorophenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-6-(4-fluorophenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-(2-chlorophenyl)-6-(4-fluorophenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
Compound ID: | D137-0481 |
Compound Name: | N-(2-chlorophenyl)-6-(4-fluorophenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
Molecular Weight: | 431.92 |
Molecular Formula: | C20 H19 Cl F N5 O S |
Smiles: | CCCc1nnc2n1NC(C(C(Nc1ccccc1[Cl])=O)S2)c1ccc(cc1)F |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.157 |
logD: | 4.1552 |
logSw: | -4.3789 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.333 |
InChI Key: | KHEIFIGMCBEZAG-UHFFFAOYSA-N |