N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | E694-0017 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 503.58 |
| Molecular Formula: | C26 H25 N5 O4 S |
| Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)NCCc1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4637 |
| logD: | 4.4637 |
| logSw: | -4.3671 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.719 |
| InChI Key: | FBUGIVOKIUDAGY-UHFFFAOYSA-N |