5-([1,4'-bipiperidin]-1'-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
5-([1,4'-bipiperidin]-1'-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
5-([1,4'-bipiperidin]-1'-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | E694-0281 |
| Compound Name: | 5-([1,4'-bipiperidin]-1'-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C27 H32 N6 O2 S |
| Smiles: | Cc1ccc(cc1C)S(c1c2nc(c3ccccc3n2nn1)N1CCC(CC1)N1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.446 |
| logD: | 2.8868 |
| logSw: | -5.6103 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.221 |
| InChI Key: | SHMLKVVNSWTCSS-UHFFFAOYSA-N |