2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 4281-0214 |
| Compound Name: | 2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 325.39 |
| Molecular Formula: | C13 H19 N5 O3 S |
| Smiles: | CCCCn1c2C(N(C)C(N(C)c2nc1SCC(N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4116 |
| logD: | 1.4116 |
| logSw: | -1.5811 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.924 |
| InChI Key: | OTXKTYNEWMVJKA-UHFFFAOYSA-N |