7-benzyl-1,3-dimethyl-8-{2-[(pyridin-4-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-benzyl-1,3-dimethyl-8-{2-[(pyridin-4-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
7-benzyl-1,3-dimethyl-8-{2-[(pyridin-4-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | 4236-1137 |
Compound Name: | 7-benzyl-1,3-dimethyl-8-{2-[(pyridin-4-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 389.42 |
Molecular Formula: | C20 H19 N7 O2 |
Smiles: | CN1C(c2c(nc(N/N=C/c3ccncc3)n2Cc2ccccc2)N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8325 |
logD: | 2.8321 |
logSw: | -2.9541 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.177 |
InChI Key: | ULWYBYXIZFTGKM-UHFFFAOYSA-N |