2-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decane
Chemical Structure Depiction of
2-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decane
2-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | SC68-1981 |
| Compound Name: | 2-(3-fluoro-4-methylbenzene-1-sulfonyl)-4-[4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]decane |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C22 H31 F N4 O2 S |
| Smiles: | CC(C)Cn1cnnc1C1CN(CC12CCCCC2)S(c1ccc(C)c(c1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0829 |
| logD: | 4.0829 |
| logSw: | -4.1941 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.459 |
| InChI Key: | BDSCLHDEKVKOIR-IBGZPJMESA-N |