3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone
TL;DR: 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone (CAS 259243-88-4) is a chemical compound with molecular formula C13H14N4O2 and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,5-dimethyl-1H-pyrrol-2-yl)methylideneamino]-4-nitroaniline
Also Known As: 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone, 3,5-Dimethyl-2-{[2-(4-nitrophenyl)hydrazinylidene]methyl}-1H-pyrrole
| Molecular Formula | C13H14N4O2 |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 2.98574 |
| Topological Polar Surface Area | 83.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.11166 |
| Heavy Atoms | 19 |
| Complexity | 614.0735 |
Chemical Identifiers
| CAS Number | 259243-88-4 |
|---|---|
| SMILES | CC1=CC(=C(N1)C=NNC2=CC=C(C=C2)[N+](=O)[O-])C |
Product Overview
3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone (CAS 259243-88-4), with molecular formula C13H14N4O2 and molecular weight 258.11 g/mol. IUPAC: N-[(3,5-dimethyl-1H-pyrrol-2-yl)methylideneamino]-4-nitroaniline.
Chemical Property Profile of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone
Property Insights of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone
The XLogP value of 2.98574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone. The TPSA of 83.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone. Following Lipinski's Rule of Five, 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone has 2 hydrogen bond donor(s) and 4 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 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone?
The CAS number of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone is 259243-88-4.
What is the molecular formula of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone?
The molecular formula of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone is C13H14N4O2.
What is the molecular weight of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone?
The molecular weight of 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone is 258.11 g/mol.
Where can I buy 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone?
You can request a quote for 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethyl-1H-pyrrole-2-carboxaldehyde 2-(4-nitrophenyl)hydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.