7-(2-methoxyethyl)-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(2-methoxyethyl)-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
7-(2-methoxyethyl)-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8010-1764 |
| Compound Name: | 7-(2-methoxyethyl)-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C17 H28 N4 O3 S |
| Smiles: | CCCCCCCCSc1nc2c(C(NC(N2C)=O)=O)n1CCOC |
| Stereo: | ACHIRAL |
| logP: | 4.559 |
| logD: | 4.5589 |
| logSw: | -4.3242 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.792 |
| InChI Key: | IROCDJQVMJLNCR-UHFFFAOYSA-N |