4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Chemical Structure Depiction of
4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}butanamide
4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}butanamide
Compound characteristics
| Compound ID: | C604-0135 |
| Compound Name: | 4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}butanamide |
| Molecular Weight: | 548.72 |
| Molecular Formula: | C26 H36 N4 O5 S2 |
| Smiles: | CC(C)OCCCNC(CCCN1C(=Nc2c3ccccc3sc2C1=O)SCC(NCCCOC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6495 |
| logD: | 1.6495 |
| logSw: | -2.3386 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.957 |
| InChI Key: | AZEZEGKATPBUPH-UHFFFAOYSA-N |