6-[2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanoic acid
Chemical Structure Depiction of
6-[2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanoic acid
6-[2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanoic acid
Compound characteristics
| Compound ID: | K292-1930 |
| Compound Name: | 6-[2-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanoic acid |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C21 H23 N3 O5 S2 |
| Smiles: | COc1ccc(cc1)NC(CSC1=Nc2ccsc2C(N1CCCCCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9827 |
| logD: | 0.1546 |
| logSw: | -3.5781 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.116 |
| InChI Key: | WVJNEQZLXBVHMR-UHFFFAOYSA-N |