3-[(4-chlorophenoxy)methyl]-5-[(3-chlorophenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one
Chemical Structure Depiction of
3-[(4-chlorophenoxy)methyl]-5-[(3-chlorophenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one
3-[(4-chlorophenoxy)methyl]-5-[(3-chlorophenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one
Compound characteristics
| Compound ID: | V018-7376 |
| Compound Name: | 3-[(4-chlorophenoxy)methyl]-5-[(3-chlorophenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one |
| Molecular Weight: | 421.3 |
| Molecular Formula: | C18 H14 Cl2 N4 O2 S |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)[Cl])N1C(CSc2nnc(COc3ccc(cc3)[Cl])n12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7139 |
| logD: | 3.7139 |
| logSw: | -4.1827 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.661 |
| InChI Key: | GYRBNPOZTGUVKF-UHFFFAOYSA-N |