N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide
N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | D356-2614 |
| Compound Name: | N-(2-{[(4-chlorophenyl)methyl]sulfanyl}ethyl)-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide |
| Molecular Weight: | 491 |
| Molecular Formula: | C23 H20 Cl F N2 O3 S2 |
| Smiles: | C(CSCc1ccc(cc1)[Cl])NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4392 |
| logD: | 4.4392 |
| logSw: | -4.691 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.075 |
| InChI Key: | BBOZTBIIKGLFAY-UHFFFAOYSA-N |