![N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide structure](/static/products/489/489422-90-4.png)
N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
TL;DR: N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide (CAS 489422-90-4) is a chemical compound with molecular formula C20H15N3O4 and molecular weight 361.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-hydroxy-1-prop-2-ynylindol-3-yl)imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Also Known As: N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide, (E)-N'-(2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)-2,3-dihydrobenzo[b][1,4]dioxine-2-carbohydrazide, N'-[(3Z)-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide, N-[(E)-(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
| Molecular Formula | C20H15N3O4 |
|---|---|
| Molecular Weight | 361.11 g/mol |
| LogP | 3.4304 |
| Topological Polar Surface Area | 85.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.10626 |
| Heavy Atoms | 27 |
| Complexity | 1094.2902 |
Chemical Identifiers
| CAS Number | 489422-90-4 |
|---|---|
| SMILES | C#CCN1C2=CC=CC=C2C(=C1O)N=NC(=O)C3COC4=CC=CC=C4O3 |
Product Overview
N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide (CAS 489422-90-4), with molecular formula C20H15N3O4 and molecular weight 361.11 g/mol. IUPAC: N-(2-hydroxy-1-prop-2-ynylindol-3-yl)imino-2,3-dihydro-1,4-benzodioxine-3-carboxamide.
Chemical Property Profile of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
Property Insights of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
The XLogP value of 3.4304 indicates that N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-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 N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide. Following Lipinski's Rule of Five, N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-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 N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide?
The CAS number of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide is 489422-90-4.
What is the molecular formula of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide?
The molecular formula of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide is C20H15N3O4.
What is the molecular weight of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide?
The molecular weight of N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide is 361.11 g/mol.
Where can I buy N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide?
You can request a quote for N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.