8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Chemical Structure Depiction of
8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | 5921-0156 |
| Compound Name: | 8-benzyl-6-(4-butanoylpiperazin-1-yl)-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile |
| Molecular Weight: | 432.57 |
| Molecular Formula: | C26 H32 N4 O2 |
| Smiles: | CCCC(N1CCN(CC1)c1c(C#N)c2CC(C)(C)OCc2c(Cc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7176 |
| logD: | 4.7176 |
| logSw: | -4.709 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.108 |
| InChI Key: | SKGXDQPJZPABQU-UHFFFAOYSA-N |