4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(oxolan-2-yl)methyl]butanamide
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-4110 |
| Compound Name: | 4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 426.33 |
| Molecular Formula: | C17 H20 Br N3 O3 S |
| Smiles: | C(CC(NCC1CCCO1)=O)CN1C(c2cc(ccc2NC1=S)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6439 |
| logD: | 1.579 |
| logSw: | -2.6103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.422 |
| InChI Key: | MHYGBNCEUJHCLE-GFCCVEGCSA-N |