5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-ethoxyphenyl)methyl]-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-ethoxyphenyl)methyl]-1,2-oxazole-3-carboxamide
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-ethoxyphenyl)methyl]-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | D337-1381 |
| Compound Name: | 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(4-ethoxyphenyl)methyl]-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 498.55 |
| Molecular Formula: | C25 H26 N2 O7 S |
| Smiles: | CCOc1ccc(CN(C2CCS(C2)(=O)=O)C(c2cc(c3ccc4c(c3)OCCO4)on2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0821 |
| logD: | 2.0821 |
| logSw: | -2.9011 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.342 |
| InChI Key: | YJTSEBGALMQFKA-LJQANCHMSA-N |