2-methylpropyl (7-methyl-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-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate
2-methylpropyl (7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate
Compound characteristics
| Compound ID: | 6197-5849 |
| Compound Name: | 2-methylpropyl (7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetate |
| Molecular Weight: | 335.42 |
| Molecular Formula: | C16 H21 N3 O3 S |
| Smiles: | CC(C)COC(CN1C(c2c3CCC(C)Cc3sc2N=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8883 |
| logD: | 3.8883 |
| logSw: | -4.2108 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.561 |
| InChI Key: | XYKPAAUHBKYSEI-SNVBAGLBSA-N |