3-(4-methoxyphenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-(4-methoxyphenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-1068 |
| Compound Name: | 3-(4-methoxyphenyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 425.48 |
| Molecular Formula: | C20 H15 N3 O4 S2 |
| Smiles: | COc1ccc(cc1)N1C(=Nc2ccsc2C1=O)SCc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3576 |
| logD: | 4.3576 |
| logSw: | -4.4663 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.103 |
| InChI Key: | VYCJESKCRNIWMT-UHFFFAOYSA-N |