(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetonitrile
Chemical Structure Depiction of
(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetonitrile
(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetonitrile
Compound characteristics
| Compound ID: | 8009-9399 |
| Compound Name: | (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetonitrile |
| Molecular Weight: | 219.2 |
| Molecular Formula: | C9 H9 N5 O2 |
| Smiles: | CN1C(c2c(ncn2CC#N)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5826 |
| logD: | -0.5826 |
| logSw: | -0.464 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.702 |
| InChI Key: | JKVAWOOMPGXBKF-UHFFFAOYSA-N |