8-[(2-hydroxypropyl)amino]-1,3-dimethyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2-hydroxypropyl)amino]-1,3-dimethyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
8-[(2-hydroxypropyl)amino]-1,3-dimethyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D114-0024 |
| Compound Name: | 8-[(2-hydroxypropyl)amino]-1,3-dimethyl-7-[(3-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C18 H23 N5 O3 |
| Smiles: | CC(CNc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1cccc(C)c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4419 |
| logD: | 2.4419 |
| logSw: | -2.6913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.596 |
| InChI Key: | SQPSJIHOKIZGIB-LBPRGKRZSA-N |