4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-hydroxyethyl)butanamide
Chemical Structure Depiction of
4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-hydroxyethyl)butanamide
4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-hydroxyethyl)butanamide
Compound characteristics
| Compound ID: | C604-0021 |
| Compound Name: | 4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-hydroxyethyl)butanamide |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C18 H20 N4 O4 S2 |
| Smiles: | C(CC(NCCO)=O)CN1C(=Nc2c3ccccc3sc2C1=O)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1052 |
| logD: | -0.1052 |
| logSw: | -1.9207 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 99.144 |
| InChI Key: | AZPVJFKNWIRKHX-UHFFFAOYSA-N |