2-{[(3-nitrophenyl)methyl]sulfanyl}-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-nitrophenyl)methyl]sulfanyl}-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one
2-{[(3-nitrophenyl)methyl]sulfanyl}-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-0214 |
| Compound Name: | 2-{[(3-nitrophenyl)methyl]sulfanyl}-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C19 H13 N3 O3 S2 |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)SC1=Nc2ccsc2C(N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2537 |
| logD: | 4.2537 |
| logSw: | -4.4169 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.559 |
| InChI Key: | UJFGLDILJLQHJW-UHFFFAOYSA-N |