3-[3-chloro-4-(morpholin-4-yl)anilino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Chemical Structure Depiction of
3-[3-chloro-4-(morpholin-4-yl)anilino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
3-[3-chloro-4-(morpholin-4-yl)anilino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione
Compound characteristics
| Compound ID: | J087-0661 |
| Compound Name: | 3-[3-chloro-4-(morpholin-4-yl)anilino]-2-(morpholine-4-carbonyl)-1H-1-benzothiophene-1,1-dione |
| Molecular Weight: | 489.98 |
| Molecular Formula: | C23 H24 Cl N3 O5 S |
| Smiles: | C1COCCN1C(C1=C(c2ccccc2S1(=O)=O)Nc1ccc(c(c1)[Cl])N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4078 |
| logD: | -0.382 |
| logSw: | -3.604 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.234 |
| InChI Key: | NDWUNVHLDKAWQA-UHFFFAOYSA-N |