ethyl 4-[4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate
ethyl 4-[4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K284-4098 |
| Compound Name: | ethyl 4-[4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]piperazine-1-carboxylate |
| Molecular Weight: | 483.38 |
| Molecular Formula: | C19 H23 Br N4 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(CCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4316 |
| logD: | 2.3667 |
| logSw: | -3.1221 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.469 |
| InChI Key: | STVZCQZDOLCNAR-UHFFFAOYSA-N |