8-[(2-hydroxy-2-phenylethyl)amino]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2-hydroxy-2-phenylethyl)amino]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(2-hydroxy-2-phenylethyl)amino]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 2612-0860 |
| Compound Name: | 8-[(2-hydroxy-2-phenylethyl)amino]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 329.36 |
| Molecular Formula: | C16 H19 N5 O3 |
| Smiles: | CN1C(c2c(nc(NCC(c3ccccc3)O)n2C)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3491 |
| logD: | 1.3489 |
| logSw: | -1.7826 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.08 |
| InChI Key: | JXNWYWZIOMMTSY-NSHDSACASA-N |