4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Chemical Structure Depiction of
4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Compound characteristics
| Compound ID: | C200-1823 |
| Compound Name: | 4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}butanamide |
| Molecular Weight: | 419.56 |
| Molecular Formula: | C20 H25 N3 O3 S2 |
| Smiles: | CC(C)OCCCNC(CCCN1C(c2c(c3ccccc3s2)NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9005 |
| logD: | 1.9 |
| logSw: | -2.5507 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.577 |
| InChI Key: | ISVZJNWSUGWASH-UHFFFAOYSA-N |