3-{[4-([1,4'-bipiperidine]-1'-carbonyl)phenyl]methyl}-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-{[4-([1,4'-bipiperidine]-1'-carbonyl)phenyl]methyl}-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-{[4-([1,4'-bipiperidine]-1'-carbonyl)phenyl]methyl}-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-6513 |
| Compound Name: | 3-{[4-([1,4'-bipiperidine]-1'-carbonyl)phenyl]methyl}-6-(morpholin-4-yl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 547.72 |
| Molecular Formula: | C30 H37 N5 O3 S |
| Smiles: | C1CCN(CC1)C1CCN(CC1)C(c1ccc(CN2C(c3cc(ccc3NC2=S)N2CCOCC2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3116 |
| logD: | -0.1278 |
| logSw: | -3.6202 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.421 |
| InChI Key: | CNGBQAJKFWONFX-UHFFFAOYSA-N |