6-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
6-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
6-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | 8020-0343 |
| Compound Name: | 6-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 419.44 |
| Molecular Formula: | C23 H21 N3 O5 |
| Smiles: | CN1C(c2c(cn(Cc3ccc4c(c3)OCO4)c2c2ccc(cc2)OC)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2862 |
| logD: | 3.2862 |
| logSw: | -3.5334 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.987 |
| InChI Key: | DHBVKJVBTAFKHP-UHFFFAOYSA-N |