4-oxo-3-[(oxolan-2-yl)methyl]-N-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
4-oxo-3-[(oxolan-2-yl)methyl]-N-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
4-oxo-3-[(oxolan-2-yl)methyl]-N-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061732 |
| Compound Name: | 4-oxo-3-[(oxolan-2-yl)methyl]-N-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | C1CC(CN2C(c3ccc(cc3NC2=S)C(NCc2cccnc2)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2909 |
| logD: | 1.2882 |
| logSw: | -2.0154 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.903 |
| InChI Key: | YOOJXLQSSRHCON-OAHLLOKOSA-N |