9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Chemical Structure Depiction of
9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile
Compound characteristics
| Compound ID: | Y020-3353 |
| Compound Name: | 9-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-1,3-diazaspiro[5.5]undec-2-ene-5-carbonitrile |
| Molecular Weight: | 303.41 |
| Molecular Formula: | C16 H25 N5 O |
| Smiles: | CC1CCC2(CC1)C(C#N)C(N=C(N2)N1CCN(C)CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1363 |
| logD: | 1.1363 |
| logSw: | -1.9899 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.481 |
| InChI Key: | CAMJBKNKKOEKAP-MFOWVQHXSA-N |