2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis(N-benzylacetamide)
Chemical Structure Depiction of
2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis(N-benzylacetamide)
2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis(N-benzylacetamide)
Compound characteristics
| Compound ID: | K284-7622 |
| Compound Name: | 2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis(N-benzylacetamide) |
| Molecular Weight: | 690.84 |
| Molecular Formula: | C37 H34 N6 O4 S2 |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCC(NCc1ccccc1)=O)CN1C(=Nc2ccccc2C1=O)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1695 |
| logD: | 4.1695 |
| logSw: | -4.2595 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.475 |
| InChI Key: | SRIIIMCZWSXTFE-UHFFFAOYSA-N |