2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-oxothiolan-3-yl)acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-oxothiolan-3-yl)acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-oxothiolan-3-yl)acetamide
Compound characteristics
Compound ID: | 4130-5637 |
Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-oxothiolan-3-yl)acetamide |
Molecular Weight: | 337.35 |
Molecular Formula: | C13 H15 N5 O4 S |
Smiles: | CN1C(c2c(ncn2CC(NC2CCSC2=O)=O)N(C)C1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | -0.8767 |
logD: | -0.9193 |
logSw: | -1.6075 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.986 |
InChI Key: | SZDGURNLRCRQDP-SSDOTTSWSA-N |