2-(3-chlorophenyl)-9-(4-ethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-9-(4-ethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
2-(3-chlorophenyl)-9-(4-ethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-4304 |
| Compound Name: | 2-(3-chlorophenyl)-9-(4-ethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 420.9 |
| Molecular Formula: | C23 H21 Cl N4 O2 |
| Smiles: | CCOc1ccc(cc1)C1C2=C(CCCC2=O)Nc2nc(c3cccc(c3)[Cl])nn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2838 |
| logD: | 5.2764 |
| logSw: | -5.947 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.468 |
| InChI Key: | JPCNAAMDVDHYMV-NRFANRHFSA-N |