4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide
Chemical Structure Depiction of
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide
Compound characteristics
| Compound ID: | K284-4074 |
| Compound Name: | 4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide |
| Molecular Weight: | 574.54 |
| Molecular Formula: | C26 H32 Br N5 O3 S |
| Smiles: | COc1ccc(cc1)N1CCN(CCCNC(CCCN2C(c3cc(ccc3NC2=S)[Br])=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.0595 |
| logD: | 2.4734 |
| logSw: | -3.5367 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.396 |
| InChI Key: | OUADHFXGFHMJLQ-UHFFFAOYSA-N |