TL;DR: C17H19N3NaO3S (CAS 161796-77-6) is a chemical compound with molecular formula C17H19N3NaO3S and molecular weight 368.1045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Also Known As: Esomeprazole Sodium, (R)-Omeprazole Sodium Salt, (+)-Omeprazole Sodium Salt, 1H-Benzimidazole, 6-methoxy-2-[(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-, sodium salt (1:1), (+)-(5)6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole Sodium Salt
| Molecular Formula | C17H19N3NaO3S |
| Molecular Weight | 368.1045 g/mol |
| XLogP | 2.51894 |
| Topological Polar Surface Area (TPSA) | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1045 Da |
| Heavy Atoms | 25 |
| Complexity | 453.0 |
| SMILES | CC1=CN=C(C(=C1OC)C)C[S@](=O)C2=NC3=C(N2)C=C(C=C3)OC.[Na] |
| InChIKey | HVAJOLFRLWQQQL-JIDHJSLPSA-N |
The XLogP value of 2.51894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C17H19N3NaO3S. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for C17H19N3NaO3S. Following Lipinski's Rule of Five, C17H19N3NaO3S has 1 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 C17H19N3NaO3S is 161796-77-6.
The molecular formula of C17H19N3NaO3S is C17H19N3NaO3S.
The molecular weight of C17H19N3NaO3S is 368.1045 g/mol.
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