2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]-N,N-diethylacetamide
Chemical Structure Depiction of
2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]-N,N-diethylacetamide
2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]-N,N-diethylacetamide
Compound characteristics
| Compound ID: | Y040-7366 |
| Compound Name: | 2-[(8-chloro-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]-N,N-diethylacetamide |
| Molecular Weight: | 349.81 |
| Molecular Formula: | C18 H20 Cl N O4 |
| Smiles: | CCN(CC)C(COc1cc2c(cc1[Cl])C1CCCC=1C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0389 |
| logD: | 3.0389 |
| logSw: | -3.5549 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.437 |
| InChI Key: | WSMSJRZXXYWHMG-UHFFFAOYSA-N |