4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-cyclopentylbutanamide
Chemical Structure Depiction of
4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-cyclopentylbutanamide
4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-cyclopentylbutanamide
Compound characteristics
| Compound ID: | C604-0051 |
| Compound Name: | 4-{2-[(2-amino-2-oxoethyl)sulfanyl]-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl}-N-cyclopentylbutanamide |
| Molecular Weight: | 444.57 |
| Molecular Formula: | C21 H24 N4 O3 S2 |
| Smiles: | C1CCC(C1)NC(CCCN1C(=Nc2c3ccccc3sc2C1=O)SCC(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1551 |
| logD: | 2.1551 |
| logSw: | -2.5804 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.466 |
| InChI Key: | QMBIKSMUJVOEMT-UHFFFAOYSA-N |