2-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylic acid
Chemical Structure Depiction of
2-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylic acid
2-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylic acid
Compound characteristics
| Compound ID: | S364-0056 |
| Compound Name: | 2-[(3-fluoro-4-methoxyphenyl)methyl]-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylic acid |
| Molecular Weight: | 328.32 |
| Molecular Formula: | C13 H13 F N2 O5 S |
| Smiles: | CC1C(=CN(Cc2ccc(c(c2)F)OC)S(N=1)(=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1215 |
| logD: | -5.5595 |
| logSw: | -2.1432 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.537 |
| InChI Key: | XDIWXTJNCRZHLH-UHFFFAOYSA-N |