4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)-2-azaspiro[4.5]decane
Chemical Structure Depiction of
4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)-2-azaspiro[4.5]decane
4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)-2-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | SC68-0112 |
| Compound Name: | 4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(5-fluoro-2-methoxybenzene-1-sulfonyl)-2-azaspiro[4.5]decane |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C20 H27 F N4 O3 S |
| Smiles: | CCn1cnnc1C1CN(CC12CCCCC2)S(c1cc(ccc1OC)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3177 |
| logD: | 2.3177 |
| logSw: | -2.7177 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.814 |
| InChI Key: | VECIOYPDCJYKKK-INIZCTEOSA-N |