7-amino-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Chemical Structure Depiction of
7-amino-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile
7-amino-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Compound characteristics
| Compound ID: | 8019-9060 |
| Compound Name: | 7-amino-5-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C16 H12 N4 O5 |
| Smiles: | COc1cc(cc2c1OCO2)C1C(C#N)=C(N)OC2=C1C(NC=N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1182 |
| logD: | 0.0941 |
| logSw: | -1.3703 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.432 |
| InChI Key: | CKXICSOZFMXATJ-LLVKDONJSA-N |