9-ethyl-7,8,9,10-tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindol-6(13H)-one
Chemical Structure Depiction of
9-ethyl-7,8,9,10-tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindol-6(13H)-one
9-ethyl-7,8,9,10-tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindol-6(13H)-one
Compound characteristics
| Compound ID: | Y500-7258 |
| Compound Name: | 9-ethyl-7,8,9,10-tetrahydro[1]benzothieno[3',2':5,6]pyrimido[2,1-a]isoindol-6(13H)-one |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C19 H18 N2 O S |
| Smiles: | CCC1CCc2c3C(N=C4c5ccccc5CN4c3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5486 |
| logD: | 3.6832 |
| logSw: | -4.6529 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.5472 |
| InChI Key: | DGTKTRHSRRYFJE-LLVKDONJSA-N |