1-[3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanoyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanoyl]piperidine-4-carboxamide
1-[3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanoyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K288-0146 |
| Compound Name: | 1-[3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanoyl]piperidine-4-carboxamide |
| Molecular Weight: | 360.43 |
| Molecular Formula: | C17 H20 N4 O3 S |
| Smiles: | C1CN(CCC1C(N)=O)C(CCN1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4275 |
| logD: | 0.4262 |
| logSw: | -2.2408 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.748 |
| InChI Key: | HXDIUMUXFHXUQK-UHFFFAOYSA-N |