methyl 2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-4,5-dimethoxybenzoate
Chemical Structure Depiction of
methyl 2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-4,5-dimethoxybenzoate
methyl 2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-4,5-dimethoxybenzoate
Compound characteristics
| Compound ID: | 7182-0044 |
| Compound Name: | methyl 2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-4,5-dimethoxybenzoate |
| Molecular Weight: | 431.4 |
| Molecular Formula: | C19 H21 N5 O7 |
| Smiles: | CN1C(c2c(ncn2CC(Nc2cc(c(cc2C(=O)OC)OC)OC)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4066 |
| logD: | 0.0837 |
| logSw: | -2.1122 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.847 |
| InChI Key: | HVMZVEDTJVRGDM-UHFFFAOYSA-N |