2-(2-bromophenoxy)-N-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
2-(2-bromophenoxy)-N-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
2-(2-bromophenoxy)-N-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | K292-1845 |
| Compound Name: | 2-(2-bromophenoxy)-N-[2-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 604.89 |
| Molecular Formula: | C23 H15 Br Cl N5 O4 S2 |
| Smiles: | C(C(NN1C(=Nc2ccsc2C1=O)SCC1=CC(N2C=C(C=CC2=N1)[Cl])=O)=O)Oc1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.0603 |
| logD: | 3.0603 |
| logSw: | -3.4981 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.068 |
| InChI Key: | YPUBKCHPXJMRER-UHFFFAOYSA-N |