4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(butan-2-yl)butanamide
Chemical Structure Depiction of
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(butan-2-yl)butanamide
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(butan-2-yl)butanamide
Compound characteristics
| Compound ID: | K284-4065 |
| Compound Name: | 4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(butan-2-yl)butanamide |
| Molecular Weight: | 398.32 |
| Molecular Formula: | C16 H20 Br N3 O2 S |
| Smiles: | CCC(C)NC(CCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.784 |
| logD: | 2.7191 |
| logSw: | -3.3693 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.481 |
| InChI Key: | IHAKZRRVEJMIIV-JTQLQIEISA-N |