9-(3-methylbutyl)-7,9-dihydro-8H-purin-8-one
Chemical Structure Depiction of
9-(3-methylbutyl)-7,9-dihydro-8H-purin-8-one
9-(3-methylbutyl)-7,9-dihydro-8H-purin-8-one
Compound characteristics
| Compound ID: | P814-4033 |
| Compound Name: | 9-(3-methylbutyl)-7,9-dihydro-8H-purin-8-one |
| Molecular Weight: | 206.24 |
| Molecular Formula: | C10 H14 N4 O |
| Smiles: | CC(C)CCN1C(Nc2cncnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9377 |
| logD: | 1.9376 |
| logSw: | -2.3607 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.875 |
| InChI Key: | ZXYAPKNOPOMZAL-UHFFFAOYSA-N |