N-[(3,4-dimethoxyphenyl)methyl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1075 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C24 H25 N O7 S |
| Smiles: | Cc1ccc2c(c1)C(C=C(C(N(Cc1ccc(c(c1)OC)OC)C1CCS(C1)(=O)=O)=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0689 |
| logD: | 2.0689 |
| logSw: | -2.9944 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.939 |
| InChI Key: | CRVKPAFPZYEGJX-QGZVFWFLSA-N |