N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-6-[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]hexanamide
Chemical Structure Depiction of
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-6-[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]hexanamide
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-6-[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]hexanamide
Compound characteristics
| Compound ID: | K284-6390 |
| Compound Name: | N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-6-[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]hexanamide |
| Molecular Weight: | 596.77 |
| Molecular Formula: | C31 H41 F N6 O3 S |
| Smiles: | C(CCC(NCCCN1CCN(CC1)c1ccccc1F)=O)CCN1C(c2cc(ccc2NC1=S)N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8963 |
| logD: | 2.5651 |
| logSw: | -3.5643 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.912 |
| InChI Key: | BOQNBJQCEJDFMJ-UHFFFAOYSA-N |