7-(2-anilinoethyl)-8-hydrazinyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(2-anilinoethyl)-8-hydrazinyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-(2-anilinoethyl)-8-hydrazinyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | 0542-0009 |
Compound Name: | 7-(2-anilinoethyl)-8-hydrazinyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 329.36 |
Molecular Formula: | C15 H19 N7 O2 |
Smiles: | CN1C(c2c(nc(NN)n2CCNc2ccccc2)N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 1.1904 |
logD: | 1.1875 |
logSw: | -1.6909 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 89.665 |
InChI Key: | KLFVNLHDKLXUQT-UHFFFAOYSA-N |