2-benzylidene-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-benzylidene-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
2-benzylidene-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-9495 |
| Compound Name: | 2-benzylidene-6-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C25 H20 N2 O2 S |
| Smiles: | C1CN(Cc2ccccc12)C(c1ccc2c(c1)NC(/C(=C/c1ccccc1)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7813 |
| logD: | 4.7813 |
| logSw: | -4.7953 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.155 |
| InChI Key: | SESLPUYGMDBMSK-UHFFFAOYSA-N |