2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide
TL;DR: 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide (CAS 413581-30-3) is a chemical compound with molecular formula C17H13N5O7 and molecular weight 399.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-5-nitro-1H-indol-3-yl)imino]-2-(4-methyl-2-nitrophenoxy)acetamide
Also Known As: 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide, (E)-2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxoindolin-3-ylidene)acetohydrazide, 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxoindol-3-yl)acetohydrazide, 2-(4-methyl-2-nitrophenoxy)-N'-[(3E)-5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
| Molecular Formula | C17H13N5O7 |
|---|---|
| Molecular Weight | 399.08 g/mol |
| LogP | 3.68762 |
| Topological Polar Surface Area | 173.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.0815 |
| Heavy Atoms | 29 |
| Complexity | 1168.4333 |
Chemical Identifiers
| CAS Number | 413581-30-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OCC(=O)N=NC2=C(NC3=C2C=C(C=C3)[N+](=O)[O-])O)[N+](=O)[O-] |
Product Overview
2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide (CAS 413581-30-3), with molecular formula C17H13N5O7 and molecular weight 399.08 g/mol. IUPAC: N-[(2-hydroxy-5-nitro-1H-indol-3-yl)imino]-2-(4-methyl-2-nitrophenoxy)acetamide.
Chemical Property Profile of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide
Property Insights of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide
The XLogP value of 3.68762 indicates that 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 173.32 Ų indicates high polarity, suggesting 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide has 2 hydrogen bond donor(s) and 8 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-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide?
The CAS number of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide is 413581-30-3.
What is the molecular formula of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide?
The molecular formula of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide is C17H13N5O7.
What is the molecular weight of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide?
The molecular weight of 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide is 399.08 g/mol.
Where can I buy 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide?
You can request a quote for 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-methyl-2-nitrophenoxy)-N'-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.