butyl 4-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
Chemical Structure Depiction of
butyl 4-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
butyl 4-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | D356-2732 |
| Compound Name: | butyl 4-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzoate |
| Molecular Weight: | 482.53 |
| Molecular Formula: | C25 H23 F N2 O5 S |
| Smiles: | CCCCOC(c1ccc(cc1)NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5532 |
| logD: | 5.5531 |
| logSw: | -5.4021 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.959 |
| InChI Key: | NHRYEZNJTUKOCU-UHFFFAOYSA-N |