7-(2-hydroxyethyl)-3-methyl-8-[(prop-2-en-1-yl)amino]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(2-hydroxyethyl)-3-methyl-8-[(prop-2-en-1-yl)amino]-3,7-dihydro-1H-purine-2,6-dione
7-(2-hydroxyethyl)-3-methyl-8-[(prop-2-en-1-yl)amino]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5228-1350 |
| Compound Name: | 7-(2-hydroxyethyl)-3-methyl-8-[(prop-2-en-1-yl)amino]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 265.27 |
| Molecular Formula: | C11 H15 N5 O3 |
| Smiles: | CN1C(NC(c2c1nc(NCC=C)n2CCO)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1717 |
| logD: | 0.1715 |
| logSw: | -1.52 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.779 |
| InChI Key: | VJSRLPIUBIABJO-UHFFFAOYSA-N |