1-(4-bromothiophen-2-yl)-4-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-(4-bromothiophen-2-yl)-4-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-(4-bromothiophen-2-yl)-4-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0089 |
| Compound Name: | 1-(4-bromothiophen-2-yl)-4-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 451.34 |
| Molecular Formula: | C21 H15 Br N4 O S |
| Smiles: | Cc1ccc(CN2C(c3ccccc3n3c(c4cc(cs4)[Br])nnc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0602 |
| logD: | 5.0602 |
| logSw: | -4.6791 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.749 |
| InChI Key: | IPDZORVWBGGUDE-UHFFFAOYSA-N |