TL;DR: 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile (CAS 326919-61-3) is a chemical compound with molecular formula C15H12N4O and molecular weight 264.1011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,7-diamino-4-pyridin-4-yl-4H-chromene-3-carbonitrile
Also Known As: BAS 00779478, 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile, 2,7-Diamino-4-pyridin-4-yl-4H-chromene-3-carbonitrile, 2,7-diamino-4-(4-pyridyl)-4H-chromene-3-carbonitrile
| Molecular Formula | C15H12N4O |
| Molecular Weight | 264.1011 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 98.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.1011 Da |
| Heavy Atoms | 20 |
| Complexity | 446.0 |
| SMILES | C1=CC2=C(C=C1N)OC(=C(C2C3=CC=NC=C3)C#N)N |
| InChIKey | UBSXLRNZVVIGMQ-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile. Following Lipinski's Rule of Five, 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile has 2 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 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile is 326919-61-3.
The molecular formula of 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile is C15H12N4O.
The molecular weight of 2,7-diamino-4-(pyridin-4-yl)-4H-chromene-3-carbonitrile is 264.1011 g/mol.
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