TL;DR: 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile (CAS 101810-72-4) is a chemical compound with molecular formula C8H6N6 and molecular weight 186.0654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-diaminopyrido[2,3-d]pyrimidine-6-carbonitrile
Also Known As: 2,4-diaminopyrido[2,3-d]pyrimidine-6-carbonitrile, 6-Cyano-5-phenyl-5 deazaaminopterin, Pyrido[2,3-d]pyrimidine-6-carbonitrile, 2,4-diamino-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H6N6 |
| Molecular Weight | 186.0654 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.0654 Da |
| Heavy Atoms | 14 |
| Complexity | 258.0 |
| SMILES | C1=C(C=NC2=NC(=NC(=C21)N)N)C#N |
| InChIKey | ASSXWYAJMDWZGO-UHFFFAOYSA-N |
The XLogP value of -0.2 indicates that 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile. Following Lipinski's Rule of Five, 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile 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 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile is 101810-72-4.
The molecular formula of 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile is C8H6N6.
The molecular weight of 2,4-Diaminopyrido[2,3-d]pyrimidine-6-carbonitrile is 186.0654 g/mol.
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