3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline
3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | 8017-1589 |
| Compound Name: | 3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-5-phenyl[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 432.93 |
| Molecular Formula: | C23 H17 Cl N4 O S |
| Smiles: | C(CSc1nnc2c3ccccc3nc(c3ccccc3)n12)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8272 |
| logD: | 5.8057 |
| logSw: | -6.3289 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.728 |
| InChI Key: | LSFJFFDIAPWKGN-UHFFFAOYSA-N |