3,3'-(propane-1,3-diyl)bis[2-{[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one]
Chemical Structure Depiction of
3,3'-(propane-1,3-diyl)bis[2-{[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one]
3,3'-(propane-1,3-diyl)bis[2-{[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one]
Compound characteristics
| Compound ID: | K284-7526 |
| Compound Name: | 3,3'-(propane-1,3-diyl)bis[2-{[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one] |
| Molecular Weight: | 702.94 |
| Molecular Formula: | C37 H46 N6 O4 S2 |
| Smiles: | CC1CC(C)CN(C1)C(CSC1=Nc2ccccc2C(N1CCCN1C(=Nc2ccccc2C1=O)SCC(N1CC(C)CC(C)C1)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1631 |
| logD: | 5.1631 |
| logSw: | -4.9472 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.051 |
| InChI Key: | XUAGTSLRCJNDLK-UHFFFAOYSA-N |