2-(3,4-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
2-(3,4-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
Compound characteristics
Compound ID: | D051-0168 |
Compound Name: | 2-(3,4-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide |
Molecular Weight: | 405.51 |
Molecular Formula: | C21 H27 N O5 S |
Smiles: | CC(C(N(Cc1ccc(C)o1)C1CCS(C1)(=O)=O)=O)Oc1ccc(C)c(C)c1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.1168 |
logD: | 3.1168 |
logSw: | -3.2077 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 57.912 |
InChI Key: | QNNUMDXHEFUMHX-UHFFFAOYSA-N |