6,6'-(1,4-phenylene)bis[4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione]
Chemical Structure Depiction of
6,6'-(1,4-phenylene)bis[4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione]
6,6'-(1,4-phenylene)bis[4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione]
Compound characteristics
| Compound ID: | 8016-2010 |
| Compound Name: | 6,6'-(1,4-phenylene)bis[4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione] |
| Molecular Weight: | 592.61 |
| Molecular Formula: | C32 H28 N6 O6 |
| Smiles: | CN1C2CN(C(C=2C(c2ccc(cc2)O)NC1=O)=O)c1ccc(cc1)N1CC2=C(C(c3ccc(cc3)O)NC(N2C)=O)C1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3609 |
| logD: | 1.3284 |
| logSw: | -1.9027 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 123.108 |
| InChI Key: | CTBXRKCFBZGCOB-UHFFFAOYSA-N |