3-[6-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[6-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[6-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
Compound ID: | K284-6417 |
Compound Name: | 3-[6-([1,4'-bipiperidin]-1'-yl)-6-oxohexyl]-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
Molecular Weight: | 527.73 |
Molecular Formula: | C28 H41 N5 O3 S |
Smiles: | C(CCC(N1CCC(CC1)N1CCCCC1)=O)CCN1C(c2cc(ccc2NC1=S)N1CCOCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.0045 |
logD: | -0.5511 |
logSw: | -3.4512 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.143 |
InChI Key: | CUZSBAUEYBCSDT-UHFFFAOYSA-N |