TL;DR: 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde (CAS 148873-36-3) is a chemical compound with molecular formula C10H6N2O3S and molecular weight 234.00992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(3-nitro-2-pyridinyl)thiophene-3-carbaldehyde
Also Known As: 4-{3-nitro-2-pyridinyl}-3-thiophenecarbaldehyde, 4-(3-nitropyridin-2-yl)thiophene-3-carbaldehyde, 4-(3-nitro-2-pyridyl)thiophene-3-carbaldehyde, AI-942/42301924
| Molecular Formula | C10H6N2O3S |
| Molecular Weight | 234.00992 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.00992 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | C1=CC(=C(N=C1)C2=CSC=C2C=O)[N+](=O)[O-] |
| InChIKey | IZRIATVCRNIOIS-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde. Following Lipinski's Rule of Five, 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde 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 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde is 148873-36-3.
The molecular formula of 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde is C10H6N2O3S.
The molecular weight of 4-{3-Nitro-2-pyridinyl}-3-thiophenecarbaldehyde is 234.00992 g/mol.
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