N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3507 |
| Compound Name: | N-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 346.38 |
| Molecular Formula: | C18 H22 N2 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(c1c2CCCCCc2on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7124 |
| logD: | 2.7076 |
| logSw: | -3.1895 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.038 |
| InChI Key: | YEEMVDBMVGXPSD-UHFFFAOYSA-N |