TL;DR: Ranitidine (CAS 1331637-48-9) is a chemical compound with molecular formula C13H22N4O3S and molecular weight 314.14127 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine
Also Known As: ranitidine, Raticina, Ranitidine Base, Gastrosedol, Ranitiget
| Molecular Formula | C13H22N4O3S |
| Molecular Weight | 314.14127 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 314.14127 Da |
| Heavy Atoms | 21 |
| Complexity | 347.0 |
| SMILES | CN/C(=C\[N+](=O)[O-])/NCCSCC1=CC=C(O1)CN(C)C |
| InChIKey | VMXUWOKSQNHOCA-UKTHLTGXSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ranitidine. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ranitidine. Following Lipinski's Rule of Five, Ranitidine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ranitidine is 1331637-48-9.
The molecular formula of Ranitidine is C13H22N4O3S.
The molecular weight of Ranitidine is 314.14127 g/mol.
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