1-ethyl-7-[2-(3-methoxyphenyl)-2-oxoethyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-ethyl-7-[2-(3-methoxyphenyl)-2-oxoethyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
1-ethyl-7-[2-(3-methoxyphenyl)-2-oxoethyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V012-6990 |
| Compound Name: | 1-ethyl-7-[2-(3-methoxyphenyl)-2-oxoethyl]-3-[4-(propan-2-yl)phenyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C25 H26 N4 O4 |
| Smiles: | CCN1C(c2c(ncn2CC(c2cccc(c2)OC)=O)N(C1=O)c1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8149 |
| logD: | 3.8149 |
| logSw: | -4.0836 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.062 |
| InChI Key: | ACRJKCXAYGVRQQ-UHFFFAOYSA-N |