6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}hexanamide
Chemical Structure Depiction of
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}hexanamide
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}hexanamide
Compound characteristics
| Compound ID: | K284-4117 |
| Compound Name: | 6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[(propan-2-yl)oxy]propyl}hexanamide |
| Molecular Weight: | 470.43 |
| Molecular Formula: | C20 H28 Br N3 O3 S |
| Smiles: | CC(C)OCCCNC(CCCCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.206 |
| logD: | 3.1411 |
| logSw: | -3.4734 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.082 |
| InChI Key: | YHERJWDVZLVWTO-UHFFFAOYSA-N |