4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
Chemical Structure Depiction of
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | K284-4024 |
| Compound Name: | 4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]benzamide |
| Molecular Weight: | 533.45 |
| Molecular Formula: | C26 H21 Br N4 O2 S |
| Smiles: | C(CNC(c1ccc(CN2C(c3cc(ccc3NC2=S)[Br])=O)cc1)=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.0807 |
| logD: | 5.0589 |
| logSw: | -5.2974 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 61.444 |
| InChI Key: | VVCQHJSKSOEXQA-UHFFFAOYSA-N |