3-{[7-methyl-2,4-dioxo-1-phenyl-5-(piperidine-1-carbonyl)-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl]methyl}benzonitrile
Chemical Structure Depiction of
3-{[7-methyl-2,4-dioxo-1-phenyl-5-(piperidine-1-carbonyl)-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl]methyl}benzonitrile
3-{[7-methyl-2,4-dioxo-1-phenyl-5-(piperidine-1-carbonyl)-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | J026-2987 |
| Compound Name: | 3-{[7-methyl-2,4-dioxo-1-phenyl-5-(piperidine-1-carbonyl)-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl]methyl}benzonitrile |
| Molecular Weight: | 479.54 |
| Molecular Formula: | C28 H25 N5 O3 |
| Smiles: | Cc1cc(C(N2CCCCC2)=O)c2C(N(Cc3cccc(C#N)c3)C(N(c3ccccc3)c2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.774 |
| logD: | 3.774 |
| logSw: | -4.0165 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.065 |
| InChI Key: | VFPCSUNBCGRDBS-UHFFFAOYSA-N |