6-[2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide
Chemical Structure Depiction of
6-[2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide
6-[2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide
Compound characteristics
| Compound ID: | K292-1383 |
| Compound Name: | 6-[2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide |
| Molecular Weight: | 588.79 |
| Molecular Formula: | C29 H40 N4 O5 S2 |
| Smiles: | CCCCN(C)C(CSC1=Nc2ccsc2C(N1CCCCCC(NCCc1ccc(c(c1)OC)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0133 |
| logD: | 3.0133 |
| logSw: | -3.2653 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.486 |
| InChI Key: | YQVRSMBYSFVTFL-UHFFFAOYSA-N |