7-chloro-3-(4-ethylbenzene-1-sulfonyl)-N-(4-fluorophenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
7-chloro-3-(4-ethylbenzene-1-sulfonyl)-N-(4-fluorophenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
7-chloro-3-(4-ethylbenzene-1-sulfonyl)-N-(4-fluorophenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-1429 |
| Compound Name: | 7-chloro-3-(4-ethylbenzene-1-sulfonyl)-N-(4-fluorophenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 481.93 |
| Molecular Formula: | C23 H17 Cl F N5 O2 S |
| Smiles: | CCc1ccc(cc1)S(c1c2nc(c3cc(ccc3n2nn1)[Cl])Nc1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2628 |
| logD: | 6.2628 |
| logSw: | -6.2565 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.295 |
| InChI Key: | XJQUMMYPVUXKCM-UHFFFAOYSA-N |