TL;DR: 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile (CAS 49837-55-0) is a chemical compound with molecular formula C14H13N3O2 and molecular weight 255.10077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile
Also Known As: 5-morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile, 5-(morpholin-4-yl)-2-phenyl-1,3-oxazole-4-carbonitrile, 5-morpholino-2-phenyloxazole-4-carbonitrile, 5-morpholino-2-phenyl-1,3-oxazol-4-yl cyanide, AB01221703-02
| Molecular Formula | C14H13N3O2 |
| Molecular Weight | 255.10077 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 62.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.10077 Da |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
| SMILES | C1COCCN1C2=C(N=C(O2)C3=CC=CC=C3)C#N |
| InChIKey | HXAFKGPIUHRJRC-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile. Following Lipinski's Rule of Five, 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile has 0 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 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile is 49837-55-0.
The molecular formula of 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile is C14H13N3O2.
The molecular weight of 5-Morpholin-4-yl-2-phenyl-1,3-oxazole-4-carbonitrile is 255.10077 g/mol.
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