2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(oxolan-2-yl)methyl]acetamide}
Chemical Structure Depiction of
2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(oxolan-2-yl)methyl]acetamide}
2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(oxolan-2-yl)methyl]acetamide}
Compound characteristics
| Compound ID: | K284-7427 |
| Compound Name: | 2,2'-{ethane-1,2-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(oxolan-2-yl)methyl]acetamide} |
| Molecular Weight: | 664.8 |
| Molecular Formula: | C32 H36 N6 O6 S2 |
| Smiles: | C1CC(CNC(CSC2=Nc3ccccc3C(N2CCN2C(=Nc3ccccc3C2=O)SCC(NCC2CCCO2)=O)=O)=O)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.9455 |
| logD: | 0.9455 |
| logSw: | -2.3057 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 117.784 |
| InChI Key: | MOFZHFUSSIRTSZ-UHFFFAOYSA-N |