N-(2,5-dimethoxyphenyl)-N-ethyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-N-ethyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(2,5-dimethoxyphenyl)-N-ethyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-0922 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-N-ethyl-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C21 H20 N2 O4 S |
| Smiles: | CCN(C(c1c2CSc3ccccc3c2on1)=O)c1cc(ccc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3322 |
| logD: | 4.3322 |
| logSw: | -4.4088 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.54 |
| InChI Key: | TXNSSKSCSONINB-UHFFFAOYSA-N |