2-{[(3-ethyl-4-oxo-6-phenyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(3-ethyl-4-oxo-6-phenyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-{[(3-ethyl-4-oxo-6-phenyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | L460-0085 |
| Compound Name: | 2-{[(3-ethyl-4-oxo-6-phenyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C23 H18 N4 O2 S2 |
| Smiles: | CCN1C(=Nc2cc(c3ccccc3)sc2C1=O)SCC1=CC(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9718 |
| logD: | 3.9718 |
| logSw: | -4.051 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.501 |
| InChI Key: | WDBDMCLQQFEVLR-UHFFFAOYSA-N |