N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3-fluorophenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3-fluorophenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3-fluorophenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D076-0290 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3-fluorophenyl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 415.44 |
| Molecular Formula: | C21 H18 F N O5 S |
| Smiles: | C1CS(CC1N(Cc1cccc(c1)F)C(C1=Cc2ccccc2OC1=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8497 |
| logD: | 1.8497 |
| logSw: | -2.6491 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.781 |
| InChI Key: | KWKCYDLMWJRLAW-QGZVFWFLSA-N |