5-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)pentanoic acid
Chemical Structure Depiction of
5-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)pentanoic acid
5-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)pentanoic acid
Compound characteristics
| Compound ID: | K292-1488 |
| Compound Name: | 5-(4-oxo-2-sulfanylidene-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)pentanoic acid |
| Molecular Weight: | 284.35 |
| Molecular Formula: | C11 H12 N2 O3 S2 |
| Smiles: | C(CCN1C(c2c(ccs2)NC1=S)=O)CC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2587 |
| logD: | -1.5695 |
| logSw: | -2.0821 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.97 |
| InChI Key: | OTVIBJCNPDCHNX-UHFFFAOYSA-N |