3-(3,5-dimethylanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Chemical Structure Depiction of
3-(3,5-dimethylanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
3-(3,5-dimethylanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Compound characteristics
| Compound ID: | J087-0546 |
| Compound Name: | 3-(3,5-dimethylanilino)-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | Cc1cc(C)cc(c1)NC1=C(C(N2CCOCC2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4812 |
| logD: | 1.9569 |
| logSw: | -3.0907 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.174 |
| InChI Key: | FGCUDTSNRZADDT-UHFFFAOYSA-N |