7-heptyl-1,3-dimethyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-heptyl-1,3-dimethyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-heptyl-1,3-dimethyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0704 |
| Compound Name: | 7-heptyl-1,3-dimethyl-8-[(morpholin-4-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 377.49 |
| Molecular Formula: | C19 H31 N5 O3 |
| Smiles: | CCCCCCCn1c2C(N(C)C(N(C)c2nc1CN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9932 |
| logD: | 2.9922 |
| logSw: | -2.7402 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.571 |
| InChI Key: | QWQNXVBZYCUNSE-UHFFFAOYSA-N |