4-[4-(methoxymethyl)-2-(propane-1-sulfonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[4-(methoxymethyl)-2-(propane-1-sulfonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
4-[4-(methoxymethyl)-2-(propane-1-sulfonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S957-0215 |
| Compound Name: | 4-[4-(methoxymethyl)-2-(propane-1-sulfonyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 459.53 |
| Molecular Formula: | C21 H28 F3 N3 O3 S |
| Smiles: | CCCS(N1CC(COC)C2(CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7825 |
| logD: | 2.7825 |
| logSw: | -3.2831 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.009 |
| InChI Key: | ATGZHSDFKWCHDE-KRWDZBQOSA-N |