2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | J095-0030 |
| Compound Name: | 2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C15 H15 N5 O2 S2 |
| Smiles: | Cn1c2c(C(NC=N2)=O)nc1SCC(Nc1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4143 |
| logD: | 1.4137 |
| logSw: | -2.5112 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.662 |
| InChI Key: | UQTHBDYONIABLH-UHFFFAOYSA-N |