5-(4-tert-butylphenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Chemical Structure Depiction of
5-(4-tert-butylphenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
5-(4-tert-butylphenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | D077-0152 |
| Compound Name: | 5-(4-tert-butylphenyl)-6-(2-hydroxy-5-methylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C25 H27 N3 O3 |
| Smiles: | Cc1ccc(c(c1)n1cc2c(C(N(C)C(N2C)=O)=O)c1c1ccc(cc1)C(C)(C)C)O |
| Stereo: | ACHIRAL |
| logP: | 5.5935 |
| logD: | 5.5929 |
| logSw: | -5.1495 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.035 |
| InChI Key: | KEYQEOFDOHDUSA-UHFFFAOYSA-N |