4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | K284-4060 |
| Compound Name: | 4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide |
| Molecular Weight: | 530.49 |
| Molecular Formula: | C24 H28 Br N5 O2 S |
| Smiles: | CN1CCN(CCCNC(c2ccc(CN3C(c4cc(ccc4NC3=S)[Br])=O)cc2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.9047 |
| logD: | 1.7544 |
| logSw: | -3.4642 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.032 |
| InChI Key: | GXZUGBUSRJHXJW-UHFFFAOYSA-N |