5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-octylbenzamide
Chemical Structure Depiction of
5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-octylbenzamide
5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-octylbenzamide
Compound characteristics
| Compound ID: | K781-3471 |
| Compound Name: | 5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-octylbenzamide |
| Molecular Weight: | 456.58 |
| Molecular Formula: | C22 H33 F N2 O5 S |
| Smiles: | CCCCCCCCNC(c1cc(ccc1F)S(N1CCC2(CC1)OCCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5578 |
| logD: | 4.5578 |
| logSw: | -4.2518 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.913 |
| InChI Key: | IJDMAYHHCQKWKU-UHFFFAOYSA-N |