VU0605298-1
TL;DR: VU0605298-1 (CAS 885181-11-3) is a chemical compound with molecular formula C23H15N5O5 and molecular weight 441.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3Z)-3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]-4-nitrobenzamide
Also Known As: VU0605298-1, (Z)-N-(1-(1-cyano-2-((furan-2-ylmethyl)amino)-2-oxoethylidene)-1H-isoindol-3-yl)-4-nitrobenzamide, N-[(3Z)-3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]-4-nitrobenzamide, F3225-8288, N-[(1Z)-1-[cyano({[(furan-2-yl)methyl]carbamoyl})methylidene]-1H-isoindol-3-yl]-4-nitrobenzamide
| Molecular Formula | C23H15N5O5 |
|---|---|
| Molecular Weight | 441.11 g/mol |
| LogP | 2.92908 |
| Topological Polar Surface Area | 150.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.10733 |
| Heavy Atoms | 33 |
| Complexity | 1348.6339 |
Chemical Identifiers
| CAS Number | 885181-11-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)/C(=C(\C#N)/C(=O)NCC3=CC=CO3)/N=C2NC(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
VU0605298-1 (CAS 885181-11-3), with molecular formula C23H15N5O5 and molecular weight 441.11 g/mol. IUPAC: N-[(3Z)-3-[1-cyano-2-(furan-2-ylmethylamino)-2-oxoethylidene]isoindol-1-yl]-4-nitrobenzamide.
Chemical Property Profile of VU0605298-1
Property Insights of VU0605298-1
The XLogP value of 2.92908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0605298-1. The TPSA of 150.63 Ų indicates high polarity, suggesting VU0605298-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, VU0605298-1 has 2 hydrogen bond donor(s) and 7 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 VU0605298-1?
The CAS number of VU0605298-1 is 885181-11-3.
What is the molecular formula of VU0605298-1?
The molecular formula of VU0605298-1 is C23H15N5O5.
What is the molecular weight of VU0605298-1?
The molecular weight of VU0605298-1 is 441.11 g/mol.
Where can I buy VU0605298-1?
You can request a quote for VU0605298-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605298-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605298-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.