6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-butylhexanamide
Chemical Structure Depiction of
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-butylhexanamide
6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-butylhexanamide
Compound characteristics
| Compound ID: | K284-4114 |
| Compound Name: | 6-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-butylhexanamide |
| Molecular Weight: | 426.37 |
| Molecular Formula: | C18 H24 Br N3 O2 S |
| Smiles: | CCCCNC(CCCCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8522 |
| logD: | 3.7873 |
| logSw: | -3.7547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.881 |
| InChI Key: | SGJICFGKLLQPPU-UHFFFAOYSA-N |