4-{3-[(adamantan-1-yl)imino]-4-(piperidin-1-yl)-1-sulfanylidene-2-azaspiro[4.5]decan-2-yl}benzonitrile
Chemical Structure Depiction of
4-{3-[(adamantan-1-yl)imino]-4-(piperidin-1-yl)-1-sulfanylidene-2-azaspiro[4.5]decan-2-yl}benzonitrile
4-{3-[(adamantan-1-yl)imino]-4-(piperidin-1-yl)-1-sulfanylidene-2-azaspiro[4.5]decan-2-yl}benzonitrile
Compound characteristics
| Compound ID: | F208-0751 |
| Compound Name: | 4-{3-[(adamantan-1-yl)imino]-4-(piperidin-1-yl)-1-sulfanylidene-2-azaspiro[4.5]decan-2-yl}benzonitrile |
| Molecular Weight: | 500.75 |
| Molecular Formula: | C31 H40 N4 S |
| Smiles: | C1CCC2(CC1)C(\C(=N/C13CC4CC(CC(C4)C3)C1)N(C2=S)c1ccc(C#N)cc1)N1CCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5234 |
| logD: | 6.5232 |
| logSw: | -6.2096 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.131 |
| InChI Key: | BYVKAZHPMTXSQB-MXSGXTRDSA-N |