3-[(2-methylpropyl)amino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Chemical Structure Depiction of
3-[(2-methylpropyl)amino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
3-[(2-methylpropyl)amino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Compound characteristics
| Compound ID: | D581-0171 |
| Compound Name: | 3-[(2-methylpropyl)amino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione |
| Molecular Weight: | 350.43 |
| Molecular Formula: | C17 H22 N2 O4 S |
| Smiles: | CC(C)CNC1=C(C(N2CCOCC2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.239 |
| logD: | 1.2381 |
| logSw: | -2.3691 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.767 |
| InChI Key: | YMSSPENGWDHGIX-UHFFFAOYSA-N |