4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)butanamide
Chemical Structure Depiction of
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)butanamide
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)butanamide
Compound characteristics
| Compound ID: | K284-4068 |
| Compound Name: | 4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)butanamide |
| Molecular Weight: | 400.29 |
| Molecular Formula: | C15 H18 Br N3 O3 S |
| Smiles: | COCCNC(CCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5224 |
| logD: | 1.4576 |
| logSw: | -2.4917 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.223 |
| InChI Key: | JPPNJRLBEDSDFN-UHFFFAOYSA-N |