3-[(2-chloro-5-methylphenoxy)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
3-[(2-chloro-5-methylphenoxy)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-[(2-chloro-5-methylphenoxy)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | 7623-0683 |
| Compound Name: | 3-[(2-chloro-5-methylphenoxy)methyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 370.86 |
| Molecular Formula: | C18 H15 Cl N4 O S |
| Smiles: | Cc1ccc(c(c1)OCc1nnc2n1N=C(CS2)c1ccccc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3477 |
| logD: | 4.0741 |
| logSw: | -4.5474 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.52 |
| InChI Key: | XTUZMSIQTUVLKE-UHFFFAOYSA-N |