6,7-dimethoxy-2-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
6,7-dimethoxy-2-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)quinazolin-4(3H)-one
6,7-dimethoxy-2-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-4737 |
| Compound Name: | 6,7-dimethoxy-2-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)quinazolin-4(3H)-one |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | COc1cc2C(NC(CSCC(N3CCN(CC3)c3ccccc3)=O)=Nc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2624 |
| logD: | 2.2621 |
| logSw: | -3.2157 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.814 |
| InChI Key: | YASWHFLBLYRORX-UHFFFAOYSA-N |