4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(3-fluoro-4-methylbenzene-1-sulfonyl)-2-azaspiro[4.4]nonane
Chemical Structure Depiction of
4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(3-fluoro-4-methylbenzene-1-sulfonyl)-2-azaspiro[4.4]nonane
4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(3-fluoro-4-methylbenzene-1-sulfonyl)-2-azaspiro[4.4]nonane
Compound characteristics
| Compound ID: | SC69-0586 |
| Compound Name: | 4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-(3-fluoro-4-methylbenzene-1-sulfonyl)-2-azaspiro[4.4]nonane |
| Molecular Weight: | 392.49 |
| Molecular Formula: | C19 H25 F N4 O2 S |
| Smiles: | CCn1cnnc1C1CN(CC12CCCC2)S(c1ccc(C)c(c1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.616 |
| logD: | 2.6159 |
| logSw: | -2.8256 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.55 |
| InChI Key: | XELIMSFPGRYYMW-INIZCTEOSA-N |