2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-9H-purine-8-thiol
Chemical Structure Depiction of
2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-9H-purine-8-thiol
2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-9H-purine-8-thiol
Compound characteristics
| Compound ID: | C301-8140 |
| Compound Name: | 2-(4-ethylanilino)-9-(4-ethylphenyl)-6-methyl-9H-purine-8-thiol |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C22 H23 N5 S |
| Smiles: | CCc1ccc(cc1)Nc1nc(C)c2c(n1)n(c1ccc(CC)cc1)c(n2)S |
| Stereo: | ACHIRAL |
| logP: | 6.3381 |
| logD: | 6.3263 |
| logSw: | -5.7884 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.79 |
| InChI Key: | ASBQDMFZVLHUKB-UHFFFAOYSA-N |