N-(4-methoxyphenyl)-6-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-6-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
N-(4-methoxyphenyl)-6-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Compound characteristics
Compound ID: | K292-1175 |
Compound Name: | N-(4-methoxyphenyl)-6-[2-{[(3-nitrophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide |
Molecular Weight: | 538.64 |
Molecular Formula: | C26 H26 N4 O5 S2 |
Smiles: | COc1ccc(cc1)NC(CCCCCN1C(=Nc2ccsc2C1=O)SCc1cccc(c1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0326 |
logD: | 5.0326 |
logSw: | -4.5436 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 90.842 |
InChI Key: | UVAMRVCCSJTABN-UHFFFAOYSA-N |