propyl 3-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]benzoate
Chemical Structure Depiction of
propyl 3-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]benzoate
propyl 3-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | D243-0327 |
| Compound Name: | propyl 3-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]benzoate |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Smiles: | CCCOC(c1cccc(c1)NC(CN1C(c2c3CCC(C)Cc3sc2N=N1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.262 |
| logD: | 5.262 |
| logSw: | -5.2145 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.953 |
| InChI Key: | JUCSYHYXSJSDAK-CYBMUJFWSA-N |