7-heptyl-8-[(3-hydroxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-heptyl-8-[(3-hydroxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
7-heptyl-8-[(3-hydroxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 2516-4500 |
| Compound Name: | 7-heptyl-8-[(3-hydroxypropyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 337.42 |
| Molecular Formula: | C16 H27 N5 O3 |
| Smiles: | CCCCCCCn1c2C(NC(N(C)c2nc1NCCCO)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.509 |
| logD: | 2.5087 |
| logSw: | -2.5092 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.779 |
| InChI Key: | IJZJPLYWFMIPPG-UHFFFAOYSA-N |