2-(morpholine-4-carbonyl)-3-(propylamino)-1H-1-benzothiophene-1,1-dione
Chemical Structure Depiction of
2-(morpholine-4-carbonyl)-3-(propylamino)-1H-1-benzothiophene-1,1-dione
2-(morpholine-4-carbonyl)-3-(propylamino)-1H-1-benzothiophene-1,1-dione
Compound characteristics
| Compound ID: | J087-0692 |
| Compound Name: | 2-(morpholine-4-carbonyl)-3-(propylamino)-1H-1-benzothiophene-1,1-dione |
| Molecular Weight: | 336.41 |
| Molecular Formula: | C16 H20 N2 O4 S |
| Smiles: | CCCNC1=C(C(N2CCOCC2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7494 |
| logD: | 0.747 |
| logSw: | -2.3518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.609 |
| InChI Key: | XSUULRMGXJUMSY-UHFFFAOYSA-N |