3-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(2-fluorophenyl)methyl]-6-methyl-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(2-fluorophenyl)methyl]-6-methyl-1-benzothiophene-2-carboxamide
3-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(2-fluorophenyl)methyl]-6-methyl-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D076-0312 |
| Compound Name: | 3-chloro-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(2-fluorophenyl)methyl]-6-methyl-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 451.96 |
| Molecular Formula: | C21 H19 Cl F N O3 S2 |
| Smiles: | Cc1ccc2c(c(C(N(Cc3ccccc3F)C3CCS(C3)(=O)=O)=O)sc2c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7221 |
| logD: | 4.7221 |
| logSw: | -4.9938 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.606 |
| InChI Key: | CGYDBLIRMRFNSA-HNNXBMFYSA-N |