{3-[(2,5-dichlorophenoxy)methyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl}(3,4-dichlorophenyl)methanone
Chemical Structure Depiction of
{3-[(2,5-dichlorophenoxy)methyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl}(3,4-dichlorophenyl)methanone
{3-[(2,5-dichlorophenoxy)methyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl}(3,4-dichlorophenyl)methanone
Compound characteristics
| Compound ID: | V003-2443 |
| Compound Name: | {3-[(2,5-dichlorophenoxy)methyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl}(3,4-dichlorophenyl)methanone |
| Molecular Weight: | 490.19 |
| Molecular Formula: | C18 H12 Cl4 N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CSc2nnc(COc3cc(ccc3[Cl])[Cl])n2N1C(c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9408 |
| logD: | 4.9408 |
| logSw: | -5.1405 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.552 |
| InChI Key: | XHPDNOPBGDQZTH-UHFFFAOYSA-N |