N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(3-methylbutyl)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-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Compound characteristics
| Compound ID: | K292-1360 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide |
| Molecular Weight: | 588.79 |
| Molecular Formula: | C29 H40 N4 O5 S2 |
| Smiles: | CC(C)CCNC(CSC1=Nc2ccsc2C(N1CCCCCC(NCCc1ccc(c(c1)OC)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.127 |
| logD: | 3.127 |
| logSw: | -3.3692 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.926 |
| InChI Key: | KDSWICHNMQCNBH-UHFFFAOYSA-N |