N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Compound characteristics
| Compound ID: | K292-1387 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide |
| Molecular Weight: | 598.74 |
| Molecular Formula: | C28 H34 N6 O5 S2 |
| Smiles: | Cc1cc(NC(CSC2=Nc3ccsc3C(N2CCCCCC(NCCc2ccc(c(c2)OC)OC)=O)=O)=O)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.5504 |
| logD: | 2.5485 |
| logSw: | -2.9206 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.626 |
| InChI Key: | FSAVHOKSZUYYBD-UHFFFAOYSA-N |