TL;DR: 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine (CAS 121405-24-1) is a chemical compound with molecular formula C18H14N4 and molecular weight 286.12186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-amine
Also Known As: 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine, 5,7-diphenyl-4-aminopyrrolo[2,3-d]pyrimidine, 5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-amine, 7H-Pyrrolo(2,3-d)pyrimidin-4-amine, 5,7-diphenyl-, 5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H14N4 |
| Molecular Weight | 286.12186 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.12186 Da |
| Heavy Atoms | 22 |
| Complexity | 362.0 |
| SMILES | C1=CC=C(C=C1)C2=CN(C3=NC=NC(=C23)N)C4=CC=CC=C4 |
| InChIKey | AFVGAHBUCVDPPI-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine is 121405-24-1.
The molecular formula of 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine is C18H14N4.
The molecular weight of 5,7-Diphenylpyrrolo(2,3-d)pyrimidin-4-amine is 286.12186 g/mol.
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