N-(3,3-diethoxypropyl)-5-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)pentanamide
Chemical Structure Depiction of
N-(3,3-diethoxypropyl)-5-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)pentanamide
N-(3,3-diethoxypropyl)-5-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)pentanamide
Compound characteristics
Compound ID: | C200-1968 |
Compound Name: | N-(3,3-diethoxypropyl)-5-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)pentanamide |
Molecular Weight: | 463.62 |
Molecular Formula: | C22 H29 N3 O4 S2 |
Smiles: | CCOC(CCNC(CCCCN1C(c2c(c3ccccc3s2)NC1=S)=O)=O)OCC |
Stereo: | ACHIRAL |
logP: | 2.2541 |
logD: | 2.2537 |
logSw: | -2.748 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 65.03 |
InChI Key: | LYEIZGONSNYVMG-UHFFFAOYSA-N |