6-[2-{[2-(4-chlorophenyl)-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-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide
6-[2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide
Compound characteristics
| Compound ID: | K292-1380 |
| Compound Name: | 6-[2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hexanamide |
| Molecular Weight: | 614.18 |
| Molecular Formula: | C30 H32 Cl N3 O5 S2 |
| Smiles: | COc1ccc(CCNC(CCCCCN2C(=Nc3ccsc3C2=O)SCC(c2ccc(cc2)[Cl])=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.2999 |
| logD: | 4.2999 |
| logSw: | -4.6205 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.589 |
| InChI Key: | BGMSGWIWFJCFKC-UHFFFAOYSA-N |