ethyl [6-carbamoyl-9-(3,4-dimethylphenyl)-2-(4-ethylphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
Chemical Structure Depiction of
ethyl [6-carbamoyl-9-(3,4-dimethylphenyl)-2-(4-ethylphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
ethyl [6-carbamoyl-9-(3,4-dimethylphenyl)-2-(4-ethylphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate
Compound characteristics
| Compound ID: | G656-1302 |
| Compound Name: | ethyl [6-carbamoyl-9-(3,4-dimethylphenyl)-2-(4-ethylphenyl)-8-oxo-8,9-dihydro-7H-purin-7-yl]acetate |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C26 H27 N5 O4 |
| Smiles: | CCc1ccc(cc1)c1nc(C(N)=O)c2c(n1)N(C(N2CC(=O)OCC)=O)c1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.653 |
| logD: | 5.653 |
| logSw: | -5.3079 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.237 |
| InChI Key: | PGMAYKGGOLNCOH-UHFFFAOYSA-N |