1-benzyl-8-[(2-hydroxypropyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-8-[(2-hydroxypropyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-8-[(2-hydroxypropyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0451 |
| Compound Name: | 1-benzyl-8-[(2-hydroxypropyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 343.38 |
| Molecular Formula: | C17 H21 N5 O3 |
| Smiles: | CC(CNc1nc2c(C(N(Cc3ccccc3)C(N2C)=O)=O)n1C)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3392 |
| logD: | 1.3389 |
| logSw: | -1.7766 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.64 |
| InChI Key: | MMBOGZMKKJDFKV-NSHDSACASA-N |