1,3-dimethyl-7-(2-phenylethyl)-8-{2-[(pyridin-3-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-7-(2-phenylethyl)-8-{2-[(pyridin-3-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-7-(2-phenylethyl)-8-{2-[(pyridin-3-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4550-0118 |
| Compound Name: | 1,3-dimethyl-7-(2-phenylethyl)-8-{2-[(pyridin-3-yl)methylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C21 H21 N7 O2 |
| Smiles: | CN1C(c2c(nc(N/N=C/c3cccnc3)n2CCc2ccccc2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2018 |
| logD: | 3.2017 |
| logSw: | -3.0069 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.245 |
| InChI Key: | YGKGNMPNEIIHIT-UHFFFAOYSA-N |