1-(4-bromothiophen-2-yl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-(4-bromothiophen-2-yl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-(4-bromothiophen-2-yl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0237 |
| Compound Name: | 1-(4-bromothiophen-2-yl)-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 451.34 |
| Molecular Formula: | C21 H15 Br N4 O S |
| Smiles: | C(CN1C(c2ccccc2n2c(c3cc(cs3)[Br])nnc12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7359 |
| logD: | 4.7359 |
| logSw: | -4.7001 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.727 |
| InChI Key: | QLRFPQWNTWUUMP-UHFFFAOYSA-N |