![Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine structure](/static/products/127/127896-58-6.webp)
Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine
TL;DR: Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine (CAS 127896-58-6) is a chemical compound with molecular formula C16H14N4O2 and molecular weight 294.11166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-3-(2-nitrophenyl)iminoisoindol-1-amine
Also Known As: N,N-dimethyl-3-(2-nitrophenyl)iminoisoindol-1-amine, N,N-dimethyl-1-[(2-nitrophenyl)imino]-1h-isoindol-3-amine, (E)-N,N-dimethyl-1-((2-nitrophenyl)imino)-1H-isoindol-3-amine, Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine
Technical Specifications
| Molecular Formula | C16H14N4O2 |
| Molecular Weight | 294.11166 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.11166 Da |
| Heavy Atoms | 22 |
| Complexity | 495.0 |
| SMILES | CN(C)C1=NC(=NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C31 |
| InChIKey | SBVGJJKQLBMRGL-UHFFFAOYSA-N |
Chemical Property Profile of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine
Property Insights of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine. Following Lipinski's Rule of Five, Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine?
The CAS number of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine is 127896-58-6.
What is the molecular formula of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine?
The molecular formula of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine is C16H14N4O2.
What is the molecular weight of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine?
The molecular weight of Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine is 294.11166 g/mol.
Where can I buy Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine?
You can request a quote for Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine?
Yes, CoreyChem provides custom synthesis services for Dimethyl-{3-[(E)-2-nitro-phenylimino]-3H-isoindol-1-yl}-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.