3-(azepane-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one
3-(azepane-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | F312-0069 |
| Compound Name: | 3-(azepane-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 351.42 |
| Molecular Formula: | C17 H21 N O5 S |
| Smiles: | CCOc1cccc2C=C(C(=O)Oc12)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9822 |
| logD: | 2.9822 |
| logSw: | -3.3579 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.097 |
| InChI Key: | FQBLCUVWJPEUJY-UHFFFAOYSA-N |