2-phenoxyethyl (7-tert-butyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate
Chemical Structure Depiction of
2-phenoxyethyl (7-tert-butyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate
2-phenoxyethyl (7-tert-butyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate
Compound characteristics
| Compound ID: | D243-0161 |
| Compound Name: | 2-phenoxyethyl (7-tert-butyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | CC(C)(C)C1CCc2c3C(N(CC(=O)OCCOc4ccccc4)N=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9708 |
| logD: | 4.9708 |
| logSw: | -4.6926 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.626 |
| InChI Key: | JKLCVIQHFZMIMG-OAHLLOKOSA-N |