7-chloro-2-{[(3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-chloro-2-{[(3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
7-chloro-2-{[(3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | K292-2082 |
| Compound Name: | 7-chloro-2-{[(3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 609.17 |
| Molecular Formula: | C29 H29 Cl N6 O3 S2 |
| Smiles: | COc1ccc(cc1)N1CCN(CCCN2C(=Nc3ccsc3C2=O)SCC2=CC(N3C=C(C=CC3=N2)[Cl])=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6898 |
| logD: | 3.5549 |
| logSw: | -4.1137 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.06 |
| InChI Key: | WPMOJURCDHZWQN-UHFFFAOYSA-N |