2-butoxyphenyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Chemical Structure Depiction of
2-butoxyphenyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
2-butoxyphenyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Compound characteristics
| Compound ID: | 8013-5749 |
| Compound Name: | 2-butoxyphenyl (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate |
| Molecular Weight: | 386.41 |
| Molecular Formula: | C19 H22 N4 O5 |
| Smiles: | CCCCOc1ccccc1OC(Cn1cnc2c1C(N(C)C(N2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3515 |
| logD: | 2.3515 |
| logSw: | -2.6693 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.606 |
| InChI Key: | XAHCPLRVOVMUQZ-UHFFFAOYSA-N |