TL;DR: 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine (CAS 1321895-41-3) is a chemical compound with molecular formula C10H10N6 and molecular weight 214.0967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-phenyldiazenylpyrimidine-4,6-diamine
Also Known As: 5-Phenylazopyrimidine-4,6-diamine, 5-phenyldiazenylpyrimidine-4,6-diamine, EINECS 259-065-0, 5-Phenylazo-pyrimidine-4,6-diamine, 5-(2-phenyldiazenyl)-4,6-Pyrimidinediamine
| Molecular Formula | C10H10N6 |
| Molecular Weight | 214.0967 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.0967 Da |
| Heavy Atoms | 16 |
| Complexity | 227.0 |
| SMILES | C1=CC=C(C=C1)N=NC2=C(N=CN=C2N)N |
| InChIKey | SNBUOLJXURTGNE-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine. Following Lipinski's Rule of Five, 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine is 1321895-41-3.
The molecular formula of 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine is C10H10N6.
The molecular weight of 5-(2-Phenyldiazenyl)-4,6-pyrimidinediamine is 214.0967 g/mol.
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