TL;DR: Niravoline (CAS 130610-93-4) is a chemical compound with molecular formula C22H25N3O3 and molecular weight 379.1896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-2-(3-nitrophenyl)-N-[(2S)-2-pyrrolidin-1-yl-2,3-dihydro-1H-inden-1-yl]acetamide
Also Known As: Niravoline, N-methyl-2-(3-nitrophenyl)-N-[(2S)-2-pyrrolidin-1-yl-2,3-dihydro-1H-inden-1-yl]acetamide, n-methyl-2-(3-nitrophenyl)-n-[(2s)-2-(pyrrolidin-1-yl)-2,3-dihydro-1h-inden-1-yl]acetamide
| Molecular Formula | C22H25N3O3 |
| Molecular Weight | 379.1896 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.1896 Da |
| Heavy Atoms | 28 |
| Complexity | 572.0 |
| SMILES | CN(C1[C@H](CC2=CC=CC=C12)N3CCCC3)C(=O)CC4=CC(=CC=C4)[N+](=O)[O-] |
| InChIKey | ZSDAQBWGAOKTSI-AIBWNMTMSA-N |
The XLogP value of 3.3 indicates that Niravoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Niravoline. Following Lipinski's Rule of Five, Niravoline has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Niravoline is 130610-93-4.
The molecular formula of Niravoline is C22H25N3O3.
The molecular weight of Niravoline is 379.1896 g/mol.
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