N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5,7-dimethyl-N-[(4-methylphenyl)methyl]-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5,7-dimethyl-N-[(4-methylphenyl)methyl]-4-oxo-4H-1-benzopyran-2-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5,7-dimethyl-N-[(4-methylphenyl)methyl]-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1651 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5,7-dimethyl-N-[(4-methylphenyl)methyl]-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C24 H25 N O5 S |
| Smiles: | Cc1ccc(CN(C2CCS(C2)(=O)=O)C(C2=CC(c3c(C)cc(C)cc3O2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6971 |
| logD: | 3.6971 |
| logSw: | -4.0663 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.678 |
| InChI Key: | MFUIYTOZXJNXSB-LJQANCHMSA-N |