ethyl 2-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6197-5845 |
| Compound Name: | ethyl 2-[2-(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 486.61 |
| Molecular Formula: | C23 H26 N4 O4 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CN1C(c2c3CCC(C)Cc3sc2N=N1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.06 |
| logD: | 3.3442 |
| logSw: | -4.5923 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.374 |
| InChI Key: | WJFHVNDKVKYBPO-GFCCVEGCSA-N |