5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1,2-oxazole-3-carboxamide
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | D337-1373 |
| Compound Name: | 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{[4-(dimethylamino)phenyl]methyl}-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 497.57 |
| Molecular Formula: | C25 H27 N3 O6 S |
| Smiles: | CN(C)c1ccc(CN(C2CCS(C2)(=O)=O)C(c2cc(c3ccc4c(c3)OCCO4)on2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8032 |
| logD: | 1.7878 |
| logSw: | -2.6569 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.023 |
| InChI Key: | OUOKOHFWFGEUAZ-HXUWFJFHSA-N |