2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline
TL;DR: 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline (CAS 71606-80-9) is a chemical compound with molecular formula C12H9N5O4 and molecular weight 287.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline
Also Known As: isonicotinaldehyde {2,4-dinitrophenyl}hydrazone, 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline
| Molecular Formula | C12H9N5O4 |
|---|---|
| Molecular Weight | 287.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.06546 |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 71606-80-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN=CC2=CC=NC=C2 |
| InChIKey | ZWVUDEXLGCVZEJ-UHFFFAOYSA-N |
Product Overview
2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline (CAS 71606-80-9), with molecular formula C12H9N5O4 and molecular weight 287.07 g/mol. IUPAC: 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline.
Chemical Property Profile of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline
Property Insights of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline. Following Lipinski's Rule of Five, 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline?
The CAS number of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline is 71606-80-9.
What is the molecular formula of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline?
The molecular formula of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline is C12H9N5O4.
What is the molecular weight of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline?
The molecular weight of 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline is 287.07 g/mol.
Where can I buy 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline?
You can request a quote for 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dinitro-N-(pyridin-4-ylmethylideneamino)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.