2-amino-5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-amino-5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
2-amino-5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 8018-7398 |
| Compound Name: | 2-amino-5-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 408.37 |
| Molecular Formula: | C18 H16 N8 O4 |
| Smiles: | C1COc2cc(ccc2O1)c1c(C2=C(N)N=C(N)NC2=O)c2C(NC(N)=Nc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | -1.4536 |
| logD: | -1.6211 |
| logSw: | -1.9589 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 9 |
| Polar surface area: | 160.354 |
| InChI Key: | SVMYGJAORAPPHT-UHFFFAOYSA-N |