2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(4-methylphenyl)methyl]acetamide}
Chemical Structure Depiction of
2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(4-methylphenyl)methyl]acetamide}
2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(4-methylphenyl)methyl]acetamide}
Compound characteristics
| Compound ID: | K284-7462 |
| Compound Name: | 2,2'-{propane-1,3-diylbis[(4-oxoquinazoline-3,2(4H)-diyl)sulfanediyl]}bis{N-[(4-methylphenyl)methyl]acetamide} |
| Molecular Weight: | 718.9 |
| Molecular Formula: | C39 H38 N6 O4 S2 |
| Smiles: | Cc1ccc(CNC(CSC2=Nc3ccccc3C(N2CCCN2C(=Nc3ccccc3C2=O)SCC(NCc2ccc(C)cc2)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0162 |
| logD: | 5.0162 |
| logSw: | -4.5513 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.475 |
| InChI Key: | FPMZVJFCGNTMOP-UHFFFAOYSA-N |