N-(2-acetamidoethyl)-4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-(2-acetamidoethyl)-4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
N-(2-acetamidoethyl)-4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K284-3985 |
| Compound Name: | N-(2-acetamidoethyl)-4-[(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)methyl]benzamide |
| Molecular Weight: | 475.36 |
| Molecular Formula: | C20 H19 Br N4 O3 S |
| Smiles: | CC(NCCNC(c1ccc(CN2C(c3cc(ccc3NC2=S)[Br])=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9675 |
| logD: | 1.9458 |
| logSw: | -2.9685 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.27 |
| InChI Key: | CZJNWKUDTMQKET-UHFFFAOYSA-N |