4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cyclopentylbutanamide
Chemical Structure Depiction of
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cyclopentylbutanamide
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cyclopentylbutanamide
Compound characteristics
| Compound ID: | K284-4078 |
| Compound Name: | 4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cyclopentylbutanamide |
| Molecular Weight: | 410.33 |
| Molecular Formula: | C17 H20 Br N3 O2 S |
| Smiles: | C1CCC(C1)NC(CCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0774 |
| logD: | 3.0125 |
| logSw: | -3.5211 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.859 |
| InChI Key: | BDONZFOJXXDCAN-UHFFFAOYSA-N |