2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-(2-{[(4-methylphenyl)methyl]sulfanyl}ethyl)acetamide
Chemical Structure Depiction of
2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-(2-{[(4-methylphenyl)methyl]sulfanyl}ethyl)acetamide
2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-(2-{[(4-methylphenyl)methyl]sulfanyl}ethyl)acetamide
Compound characteristics
| Compound ID: | D289-0416 |
| Compound Name: | 2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)-N-(2-{[(4-methylphenyl)methyl]sulfanyl}ethyl)acetamide |
| Molecular Weight: | 480.65 |
| Molecular Formula: | C26 H28 N2 O3 S2 |
| Smiles: | CCc1ccc2c(c1)c1ccccc1S(N2CC(NCCSCc1ccc(C)cc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.991 |
| logD: | 4.991 |
| logSw: | -4.5617 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.075 |
| InChI Key: | NGWTXUMHXFAJGI-UHFFFAOYSA-N |