6-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(4-methoxyphenyl)hexanamide
Chemical Structure Depiction of
6-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(4-methoxyphenyl)hexanamide
6-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(4-methoxyphenyl)hexanamide
Compound characteristics
| Compound ID: | K292-1219 |
| Compound Name: | 6-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(4-methoxyphenyl)hexanamide |
| Molecular Weight: | 596.13 |
| Molecular Formula: | C28 H26 Cl N5 O4 S2 |
| Smiles: | COc1ccc(cc1)NC(CCCCCN1C(=Nc2ccsc2C1=O)SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8599 |
| logD: | 3.8598 |
| logSw: | -4.3474 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.966 |
| InChI Key: | ZOWUGZYZURVASG-UHFFFAOYSA-N |