TL;DR: (3-Nitro-pyridin-2-ylamino)-acetic acid (CAS 118807-77-5) is a chemical compound with molecular formula C7H7N3O4 and molecular weight 197.04366 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3-nitro-2-pyridinyl)amino]acetic acid
Also Known As: (3-Nitro-pyridin-2-ylamino)-acetic acid, 2-[(3-nitropyridin-2-yl)amino]acetic Acid, (3-Nitropyridin-2-yl)glycine, N-(3-Nitropyridin-2-yl)glycine, 2-[(3-nitro-2-pyridinyl)amino]acetic acid
| Molecular Formula | C7H7N3O4 |
| Molecular Weight | 197.04366 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.04366 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | C1=CC(=C(N=C1)NCC(=O)O)[N+](=O)[O-] |
| InChIKey | WKQYCYIBTQRMTP-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Nitro-pyridin-2-ylamino)-acetic acid. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Nitro-pyridin-2-ylamino)-acetic acid. Following Lipinski's Rule of Five, (3-Nitro-pyridin-2-ylamino)-acetic acid has 2 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 (3-Nitro-pyridin-2-ylamino)-acetic acid is 118807-77-5.
The molecular formula of (3-Nitro-pyridin-2-ylamino)-acetic acid is C7H7N3O4.
The molecular weight of (3-Nitro-pyridin-2-ylamino)-acetic acid is 197.04366 g/mol.
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