N-(3-methoxypropyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
N-(3-methoxypropyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide
Compound characteristics
| Compound ID: | C200-1822 |
| Compound Name: | N-(3-methoxypropyl)-4-(4-oxo-2-sulfanylidene-1,4-dihydro[1]benzothieno[3,2-d]pyrimidin-3(2H)-yl)butanamide |
| Molecular Weight: | 391.51 |
| Molecular Formula: | C18 H21 N3 O3 S2 |
| Smiles: | COCCCNC(CCCN1C(c2c(c3ccccc3s2)NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4265 |
| logD: | 1.426 |
| logSw: | -2.2954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.718 |
| InChI Key: | CLWOSKQTLHRKQL-UHFFFAOYSA-N |