![2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide structure](/static/products/488/488709-47-3.png)
2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide
TL;DR: 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide (CAS 488709-47-3) is a chemical compound with molecular formula C21H21N3O4 and molecular weight 379.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-butyl-2-hydroxyindol-3-yl)imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide, (E)-N'-(1-butyl-2-oxoindolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, N-[(1-butyl-2-oxoindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, N-[(E)-(1-butyl-2-oxoindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, N'-[(3Z)-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
| Molecular Formula | C21H21N3O4 |
|---|---|
| Molecular Weight | 379.15 g/mol |
| LogP | 4.5973 |
| Topological Polar Surface Area | 85.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.1532 |
| Heavy Atoms | 28 |
| Complexity | 1041.3068 |
Chemical Identifiers
| CAS Number | 488709-47-3 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2C(=C1O)N=NC(=O)C3COC4=CC=CC=C4O3 |
Product Overview
2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide (CAS 488709-47-3), with molecular formula C21H21N3O4 and molecular weight 379.15 g/mol. IUPAC: N-(1-butyl-2-hydroxyindol-3-yl)imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide
Property Insights of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide
The XLogP value of 4.5973 indicates that 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide. Following Lipinski's Rule of Five, 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide has 1 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 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide?
The CAS number of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide is 488709-47-3.
What is the molecular formula of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide?
The molecular formula of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide is C21H21N3O4.
What is the molecular weight of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide?
The molecular weight of 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide is 379.15 g/mol.
Where can I buy 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide?
You can request a quote for 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2H,3H-benzo[e]1,4-dioxin-2-yl-N-[(1-butyl-2-oxobenzo[d]azolin-3-ylidene)azamet hyl]carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.