N-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pyridine-4-carboxamide
Chemical Structure Depiction of
N-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pyridine-4-carboxamide
N-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pyridine-4-carboxamide
Compound characteristics
| Compound ID: | K284-1044 |
| Compound Name: | N-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)pyridine-4-carboxamide |
| Molecular Weight: | 298.32 |
| Molecular Formula: | C14 H10 N4 O2 S |
| Smiles: | c1ccc2c(c1)C(N(C(N2)=S)NC(c1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6633 |
| logD: | -2.3752 |
| logSw: | -1.9835 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.147 |
| InChI Key: | HKUHQGWFXGGDMR-UHFFFAOYSA-N |