6-[(1-ethyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-9H-purin-2-amine
Chemical Structure Depiction of
6-[(1-ethyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-9H-purin-2-amine
6-[(1-ethyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-9H-purin-2-amine
Compound characteristics
| Compound ID: | 8012-7952 |
| Compound Name: | 6-[(1-ethyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-9H-purin-2-amine |
| Molecular Weight: | 320.33 |
| Molecular Formula: | C11 H12 N8 O2 S |
| Smiles: | CCn1c(c(nc1C)[N+]([O-])=O)Sc1c2c(nc(N)n1)[nH]cn2 |
| Stereo: | ACHIRAL |
| logP: | 0.939 |
| logD: | 0.938 |
| logSw: | -2.1427 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.539 |
| InChI Key: | ZEFQYYBXNUKUPC-UHFFFAOYSA-N |