7-butyl-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-butyl-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-butyl-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0060 |
| Compound Name: | 7-butyl-8-[(4-ethylpiperazin-1-yl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C18 H30 N6 O2 |
| Smiles: | CCCCn1c2C(N(C)C(N(C)c2nc1CN1CCN(CC)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.612 |
| logD: | 0.5012 |
| logSw: | -1.4809 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.2 |
| InChI Key: | FKBKFRBLPNEYJA-UHFFFAOYSA-N |