methyl 4-chloro-3-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-chloro-3-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
methyl 4-chloro-3-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | D356-2712 |
| Compound Name: | methyl 4-chloro-3-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate |
| Molecular Weight: | 474.89 |
| Molecular Formula: | C22 H16 Cl F N2 O5 S |
| Smiles: | COC(c1ccc(c(c1)NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)F)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4202 |
| logD: | 4.4197 |
| logSw: | -4.5001 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.387 |
| InChI Key: | KAMIDONOXKYLBF-UHFFFAOYSA-N |