N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | D447-0339 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Molecular Weight: | 434.5 |
| Molecular Formula: | C27 H22 N4 O2 |
| Smiles: | Cc1ccccc1n1cc(c2ccccc2)c2c(NCc3ccc4c(c3)OCO4)ncnc12 |
| Stereo: | ACHIRAL |
| logP: | 5.7958 |
| logD: | 5.6977 |
| logSw: | -5.8458 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.516 |
| InChI Key: | JPRPZKTXRMYTOW-UHFFFAOYSA-N |