2-{[4-(hydroxymethyl)-2-(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decan-8-yl]methyl}benzonitrile
Chemical Structure Depiction of
2-{[4-(hydroxymethyl)-2-(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decan-8-yl]methyl}benzonitrile
2-{[4-(hydroxymethyl)-2-(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decan-8-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | S635-2815 |
| Compound Name: | 2-{[4-(hydroxymethyl)-2-(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decan-8-yl]methyl}benzonitrile |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C21 H25 N5 O |
| Smiles: | C1CN(CCC12CN(CC2CO)c1ncccn1)Cc1ccccc1C#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3349 |
| logD: | 2.0196 |
| logSw: | -2.4426 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.918 |
| InChI Key: | JTCZSRNWXIMODA-LJQANCHMSA-N |