6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(morpholin-4-yl)propyl]hexanamide
Chemical Structure Depiction of
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(morpholin-4-yl)propyl]hexanamide
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(morpholin-4-yl)propyl]hexanamide
Compound characteristics
Compound ID: | K284-4120 |
Compound Name: | 6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(morpholin-4-yl)propyl]hexanamide |
Molecular Weight: | 497.45 |
Molecular Formula: | C21 H29 Br N4 O3 S |
Smiles: | C(CCC(NCCCN1CCOCC1)=O)CCN1C(c2cc(ccc2NC1=S)[Br])=O |
Stereo: | ACHIRAL |
logP: | 2.2352 |
logD: | 1.8117 |
logSw: | -3.1322 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 63.5 |
InChI Key: | WZLWEYOVUZVDGD-UHFFFAOYSA-N |