3-methyl-N-[(4-methylphenyl)methyl]-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
3-methyl-N-[(4-methylphenyl)methyl]-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
3-methyl-N-[(4-methylphenyl)methyl]-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
Compound ID: | 7238-0982 |
Compound Name: | 3-methyl-N-[(4-methylphenyl)methyl]-6-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
Molecular Weight: | 379.48 |
Molecular Formula: | C20 H21 N5 O S |
Smiles: | Cc1ccc(CNC(C2C(c3ccccc3)Nn3c(C)nnc3S2)=O)cc1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.546 |
logD: | 2.546 |
logSw: | -2.7427 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 62.154 |
InChI Key: | IUGAOIZUNQYHHN-UHFFFAOYSA-N |