4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-cycloheptylbenzamide
Chemical Structure Depiction of
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-cycloheptylbenzamide
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-cycloheptylbenzamide
Compound characteristics
| Compound ID: | K284-4003 |
| Compound Name: | 4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-cycloheptylbenzamide |
| Molecular Weight: | 486.43 |
| Molecular Formula: | C23 H24 Br N3 O2 S |
| Smiles: | C1CCCC(CC1)NC(c1ccc(CN2C(c3cc(ccc3NC2=S)[Br])=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6245 |
| logD: | 5.6027 |
| logSw: | -5.7216 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.788 |
| InChI Key: | FHLULAZJOWNLNW-UHFFFAOYSA-N |