4,7-dioxo-2-(piperidin-1-yl)-5-(3,4,5-trimethoxyphenyl)-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-6-carbonitrile
Chemical Structure Depiction of
4,7-dioxo-2-(piperidin-1-yl)-5-(3,4,5-trimethoxyphenyl)-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-6-carbonitrile
4,7-dioxo-2-(piperidin-1-yl)-5-(3,4,5-trimethoxyphenyl)-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-6-carbonitrile
Compound characteristics
| Compound ID: | Y020-6396 |
| Compound Name: | 4,7-dioxo-2-(piperidin-1-yl)-5-(3,4,5-trimethoxyphenyl)-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-6-carbonitrile |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C22 H25 N5 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C1C(C#N)C(NC2=C1C(NC(=N2)N1CCCCC1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.913 |
| logD: | 0.8781 |
| logSw: | -2.0854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.415 |
| InChI Key: | GWRQHZGYLBETQS-UHFFFAOYSA-N |