6-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-5-(2-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
6-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-5-(2-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
6-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-5-(2-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | 8020-0345 |
| Compound Name: | 6-[(2H-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-5-(2-methylphenyl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C23 H21 N3 O4 |
| Smiles: | Cc1ccccc1c1c2C(N(C)C(N(C)c2cn1Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6495 |
| logD: | 3.6495 |
| logSw: | -3.9951 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.444 |
| InChI Key: | IWPGKFCBFUZTOU-UHFFFAOYSA-N |