5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-[(4-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-[(4-methylphenyl)methyl]benzamide
5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-[(4-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | K781-3392 |
| Compound Name: | 5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluoro-N-[(4-methylphenyl)methyl]benzamide |
| Molecular Weight: | 448.51 |
| Molecular Formula: | C22 H25 F N2 O5 S |
| Smiles: | Cc1ccc(CNC(c2cc(ccc2F)S(N2CCC3(CC2)OCCO3)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.252 |
| logD: | 3.2511 |
| logSw: | -3.6294 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.8 |
| InChI Key: | COTZGEHDKJXFBO-UHFFFAOYSA-N |