3-[(4-tert-butylphenoxy)methyl]-5-[(3-methoxyphenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one
Chemical Structure Depiction of
3-[(4-tert-butylphenoxy)methyl]-5-[(3-methoxyphenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one
3-[(4-tert-butylphenoxy)methyl]-5-[(3-methoxyphenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one
Compound characteristics
| Compound ID: | V021-3813 |
| Compound Name: | 3-[(4-tert-butylphenoxy)methyl]-5-[(3-methoxyphenyl)methyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6(7H)-one |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)OCc1nnc2n1N(Cc1cccc(c1)OC)C(CS2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3136 |
| logD: | 4.3136 |
| logSw: | -4.4474 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.205 |
| InChI Key: | JZTXSNDXGJLHNH-UHFFFAOYSA-N |