N-(3-chloro-4-methylphenyl)-3-(3,4-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-(3,4-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
N-(3-chloro-4-methylphenyl)-3-(3,4-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
Compound characteristics
| Compound ID: | E565-0257 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-(3,4-dimethylbenzene-1-sulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine |
| Molecular Weight: | 484 |
| Molecular Formula: | C22 H18 Cl N5 O2 S2 |
| Smiles: | Cc1ccc(cc1C)S(c1c2nc(c3c(ccs3)n2nn1)Nc1ccc(C)c(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.695 |
| logD: | 6.695 |
| logSw: | -6.5964 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.313 |
| InChI Key: | QLKRWHZAELNPOK-UHFFFAOYSA-N |