4-({2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-({2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl acetate
4-({2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 3254-0639 |
| Compound Name: | 4-({2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]hydrazinylidene}methyl)-2-methoxyphenyl acetate |
| Molecular Weight: | 428.4 |
| Molecular Formula: | C19 H20 N6 O6 |
| Smiles: | CC(=O)Oc1ccc(/C=N/NC(Cn2cnc3c2C(N(C)C(N3C)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 0.2521 |
| logD: | 0.252 |
| logSw: | -2.1524 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.802 |
| InChI Key: | ACQVPVJIGTUPJK-UHFFFAOYSA-N |