N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1070 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-methoxyphenyl)methyl]-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C23 H23 N O6 S |
| Smiles: | Cc1ccc2c(c1)C(C=C(C(N(Cc1ccc(cc1)OC)C1CCS(C1)(=O)=O)=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4783 |
| logD: | 2.4783 |
| logSw: | -2.9757 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.222 |
| InChI Key: | VBAQZAWEEMSAHA-QGZVFWFLSA-N |