8-[(2-aminoethyl)amino]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2-aminoethyl)amino]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-[(2-aminoethyl)amino]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7706-0417 |
| Compound Name: | 8-[(2-aminoethyl)amino]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C18 H24 N6 O4 |
| Smiles: | Cc1cccc(c1)OCC(Cn1c2C(NC(N(C)c2nc1NCCN)=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1076 |
| logD: | -2.1587 |
| logSw: | -2.1999 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 109.147 |
| InChI Key: | DZSJRXKWPLGVNM-LBPRGKRZSA-N |