[1,5-dioxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetonitrile
Chemical Structure Depiction of
[1,5-dioxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetonitrile
[1,5-dioxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetonitrile
Compound characteristics
| Compound ID: | F366-0216 |
| Compound Name: | [1,5-dioxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetonitrile |
| Molecular Weight: | 345.36 |
| Molecular Formula: | C19 H15 N5 O2 |
| Smiles: | C(CN1C2=NN(CC#N)C(N2c2ccccc2C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1488 |
| logD: | 2.1488 |
| logSw: | -2.9011 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 65.655 |
| InChI Key: | YRRNHIYPCNPSJB-UHFFFAOYSA-N |