7-amino-5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-hydroxy-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Chemical Structure Depiction of
7-amino-5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-hydroxy-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
7-amino-5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-hydroxy-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Compound characteristics
| Compound ID: | 8019-8203 |
| Compound Name: | 7-amino-5-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-hydroxy-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile |
| Molecular Weight: | 370.32 |
| Molecular Formula: | C17 H14 N4 O6 |
| Smiles: | COc1cc(C2C(C#N)=C(N)Oc3c2c(ncn3)O)c(c2c1OCO2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6078 |
| logD: | 0.5174 |
| logSw: | -1.5104 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.815 |
| InChI Key: | HSXNVQVFXKVPGK-JTQLQIEISA-N |