2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis[N-(4-ethoxyphenyl)acetamide]
Chemical Structure Depiction of
2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis[N-(4-ethoxyphenyl)acetamide]
2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis[N-(4-ethoxyphenyl)acetamide]
Compound characteristics
| Compound ID: | K284-2789 |
| Compound Name: | 2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis[N-(4-ethoxyphenyl)acetamide] |
| Molecular Weight: | 736.87 |
| Molecular Formula: | C38 H36 N6 O6 S2 |
| Smiles: | CCOc1ccc(cc1)NC(CSC1=Nc2ccccc2C(N1CCN1C(=Nc2ccccc2C1=O)SCC(Nc1ccc(cc1)OCC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4098 |
| logD: | 5.4098 |
| logSw: | -5.3318 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.078 |
| InChI Key: | XIRXCLDQQBYBDK-UHFFFAOYSA-N |