2-methylpropyl (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-methylpropyl (7-tert-butyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate
2-methylpropyl (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: | D243-0148 |
| Compound Name: | 2-methylpropyl (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: | 377.5 |
| Molecular Formula: | C19 H27 N3 O3 S |
| Smiles: | CC(C)COC(CN1C(c2c3CCC(Cc3sc2N=N1)C(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0115 |
| logD: | 5.0115 |
| logSw: | -4.662 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.561 |
| InChI Key: | PTQSEAYJSZBFCI-GFCCVEGCSA-N |