N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | D337-1874 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 444.48 |
| Molecular Formula: | C22 H21 F N2 O5 S |
| Smiles: | COc1ccc(cc1)c1cc(C(N(Cc2ccc(cc2)F)C2CCS(C2)(=O)=O)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7579 |
| logD: | 2.7579 |
| logSw: | -3.2737 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.939 |
| InChI Key: | XFSSNCPLNVYCSH-GOSISDBHSA-N |