8-(benzylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(benzylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(benzylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
Compound ID: | 7706-0354 |
Compound Name: | 8-(benzylamino)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
Molecular Weight: | 435.48 |
Molecular Formula: | C23 H25 N5 O4 |
Smiles: | CN1C(c2c(nc(NCc3ccccc3)n2CC(COc2ccccc2)O)N(C)C1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3069 |
logD: | 3.3067 |
logSw: | -3.301 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.965 |
InChI Key: | FFLUCQHJFUWYLV-KRWDZBQOSA-N |