2-(4-benzylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Chemical Structure Depiction of
2-(4-benzylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
2-(4-benzylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Compound characteristics
| Compound ID: | 8017-2021 |
| Compound Name: | 2-(4-benzylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile |
| Molecular Weight: | 365.48 |
| Molecular Formula: | C21 H27 N5 O |
| Smiles: | C1CCC2(CC1)C(C#N)C(N=C(N2)N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.114 |
| logD: | 2.114 |
| logSw: | -2.7709 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.544 |
| InChI Key: | VVESPOLSCWHYJI-GOSISDBHSA-N |