4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide
Chemical Structure Depiction of
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide
Compound characteristics
| Compound ID: | K284-4007 |
| Compound Name: | 4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide |
| Molecular Weight: | 500.46 |
| Molecular Formula: | C24 H26 Br N3 O2 S |
| Smiles: | CC1CCCC(C1C)NC(c1ccc(CN2C(c3cc(ccc3NC2=S)[Br])=O)cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2211 |
| logD: | 5.1993 |
| logSw: | -4.936 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.847 |
| InChI Key: | RDUFJXLMSGZAHJ-UHFFFAOYSA-N |