6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)hexanamide
Chemical Structure Depiction of
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)hexanamide
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)hexanamide
Compound characteristics
| Compound ID: | K284-4116 |
| Compound Name: | 6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2-methoxyethyl)hexanamide |
| Molecular Weight: | 428.35 |
| Molecular Formula: | C17 H22 Br N3 O3 S |
| Smiles: | COCCNC(CCCCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5325 |
| logD: | 2.4676 |
| logSw: | -3.1656 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.223 |
| InChI Key: | UJSCKFFXZFFGMG-UHFFFAOYSA-N |