2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Chemical Structure Depiction of
2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Compound characteristics
| Compound ID: | Y020-1656 |
| Compound Name: | 2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile |
| Molecular Weight: | 381.48 |
| Molecular Formula: | C21 H27 N5 O2 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C1NC2(CCCCC2)C(C#N)C(N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5368 |
| logD: | -2.1514 |
| logSw: | -2.9636 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.808 |
| InChI Key: | ZIISMODHKSYFGB-GOSISDBHSA-N |