N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide
TL;DR: N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide (CAS 289721-72-8) is a chemical compound with molecular formula C21H22N4O4 and molecular weight 394.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(4-butoxyphenyl)methylideneamino]-3-methyl-7-nitro-1H-indole-2-carboxamide
Also Known As: (E)-N'-(4-butoxybenzylidene)-3-methyl-7-nitro-1H-indole-2-carbohydrazide, N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide, N-[(1E)-2-(4-butoxyphenyl)-1-azavinyl](3-methyl-7-nitroindol-2-yl)carboxamide, N-[(E)-(4-butoxyphenyl)methylideneamino]-3-methyl-7-nitro-1H-indole-2-carboxamide
| Molecular Formula | C21H22N4O4 |
|---|---|
| Molecular Weight | 394.16 g/mol |
| LogP | 4.32732 |
| Topological Polar Surface Area | 109.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 394.1641 |
| Heavy Atoms | 29 |
| Complexity | 1054.4784 |
Chemical Identifiers
| CAS Number | 289721-72-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=C(C3=C(N2)C(=CC=C3)[N+](=O)[O-])C |
Product Overview
N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide (CAS 289721-72-8), with molecular formula C21H22N4O4 and molecular weight 394.16 g/mol. IUPAC: N-[(E)-(4-butoxyphenyl)methylideneamino]-3-methyl-7-nitro-1H-indole-2-carboxamide.
Chemical Property Profile of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide
Property Insights of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide
The XLogP value of 4.32732 indicates that N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.62 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide. Following Lipinski's Rule of Five, N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide has 2 hydrogen bond donor(s) and 5 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 N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide?
The CAS number of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide is 289721-72-8.
What is the molecular formula of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide?
The molecular formula of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide is C21H22N4O4.
What is the molecular weight of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide?
The molecular weight of N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide is 394.16 g/mol.
Where can I buy N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide?
You can request a quote for N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-[(E)-(4-butoxyphenyl)methylidene]-3-methyl-7-nitro-1H-indole-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.