N-tert-butyl-2-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzamide
Chemical Structure Depiction of
N-tert-butyl-2-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzamide
N-tert-butyl-2-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzamide
Compound characteristics
Compound ID: | D289-0445 |
Compound Name: | N-tert-butyl-2-[2-(9-ethyl-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzamide |
Molecular Weight: | 491.61 |
Molecular Formula: | C27 H29 N3 O4 S |
Smiles: | CCc1ccc2c(c1)c1ccccc1S(N2CC(Nc1ccccc1C(NC(C)(C)C)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.69 |
logD: | 4.6897 |
logSw: | -4.4331 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 76.722 |
InChI Key: | YNYWKWLDUFMXGE-UHFFFAOYSA-N |