N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]acetamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]acetamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | K284-7656 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]acetamide |
| Molecular Weight: | 543.69 |
| Molecular Formula: | C30 H33 N5 O3 S |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(Cc2ccc(cc2)N2C(c3ccccc3NC2=S)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.1214 |
| logD: | 2.5353 |
| logSw: | -3.6597 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.535 |
| InChI Key: | NHDWHHKMMVTAPX-UHFFFAOYSA-N |