2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone
TL;DR: 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone (CAS 61863-52-3) is a chemical compound with molecular formula C22H21N5O4 and molecular weight 419.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitroaniline
Also Known As: 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone, 2H-ISOINDOLE-1-CARBOXALDEHYDE, 4,5,6,7-TETRAHYDRO-5(or 6)-METHYL-2-PHENYL-, (2,4, N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitroaniline, RefChem:1065279
| Molecular Formula | C22H21N5O4 |
|---|---|
| Molecular Weight | 419.16 g/mol |
| LogP | 4.8645 |
| Topological Polar Surface Area | 115.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.15936 |
| Heavy Atoms | 31 |
| Complexity | 1170.1444 |
Chemical Identifiers
| CAS Number | 61863-52-3 |
|---|---|
| SMILES | CC1CCC2=C(N(C=C2C1)C3=CC=CC=C3)/C=N\NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone (CAS 61863-52-3), with molecular formula C22H21N5O4 and molecular weight 419.16 g/mol. IUPAC: N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitroaniline.
Chemical Property Profile of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone
Property Insights of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone
The XLogP value of 4.8645 indicates that 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone. Following Lipinski's Rule of Five, 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone has 1 hydrogen bond donor(s) and 6 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 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone?
The CAS number of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone is 61863-52-3.
What is the molecular formula of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone?
The molecular formula of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone is C22H21N5O4.
What is the molecular weight of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone?
The molecular weight of 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone is 419.16 g/mol.
Where can I buy 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone?
You can request a quote for 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone?
Yes, KEHONG BIO provides custom synthesis services for 2H-Isoindole-1-carboxaldehyde, 4,5,6,7-tetrahydro-5(or 6)-methyl-2-phenyl-, (2,4-dinitrophenyl)hydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.