5-(4-benzylpiperidin-1-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
5-(4-benzylpiperidin-1-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
5-(4-benzylpiperidin-1-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | E694-0277 |
| Compound Name: | 5-(4-benzylpiperidin-1-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 511.65 |
| Molecular Formula: | C29 H29 N5 O2 S |
| Smiles: | Cc1ccc(cc1C)S(c1c2nc(c3ccccc3n2nn1)N1CCC(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0683 |
| logD: | 7.0683 |
| logSw: | -6.0694 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.857 |
| InChI Key: | IDZSHTZCBGESSM-UHFFFAOYSA-N |