TL;DR: N6-phenyl-9H-purine-2,6-diamine (CAS 14051-72-0) is a chemical compound with molecular formula C11H10N6 and molecular weight 226.0967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-N-phenyl-7H-purine-2,6-diamine
Also Known As: N6-phenyl-9H-purine-2,6-diamine, 2-Amino-6-anilino-9H-purine, 2-Amino-6-phenylamino-9H-purine, 6-N-phenyl-7H-purine-2,6-diamine, 9H-Purine-2,6-diamine,N6-phenyl-
| Molecular Formula | C11H10N6 |
| Molecular Weight | 226.0967 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 92.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.0967 Da |
| Heavy Atoms | 17 |
| Complexity | 254.0 |
| SMILES | C1=CC=C(C=C1)NC2=NC(=NC3=C2NC=N3)N |
| InChIKey | AWRCGEJILTVONY-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N6-phenyl-9H-purine-2,6-diamine. The TPSA of 92.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N6-phenyl-9H-purine-2,6-diamine. Following Lipinski's Rule of Five, N6-phenyl-9H-purine-2,6-diamine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N6-phenyl-9H-purine-2,6-diamine is 14051-72-0.
The molecular formula of N6-phenyl-9H-purine-2,6-diamine is C11H10N6.
The molecular weight of N6-phenyl-9H-purine-2,6-diamine is 226.0967 g/mol.
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