N-(4-fluorophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide
N-(4-fluorophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide
Compound characteristics
Compound ID: | D243-0476 |
Compound Name: | N-(4-fluorophenyl)-2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d][1,2,3]triazin-3(4H)-yl)propanamide |
Molecular Weight: | 372.42 |
Molecular Formula: | C18 H17 F N4 O2 S |
Smiles: | CC(C(Nc1ccc(cc1)F)=O)N1C(c2c3CCCCc3sc2N=N1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9685 |
logD: | 3.9684 |
logSw: | -4.2606 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.652 |
InChI Key: | SXLOMJHFDNCNDS-JTQLQIEISA-N |