VU0604955-1
TL;DR: VU0604955-1 (CAS 845652-43-9) is a chemical compound with molecular formula C21H15N5O2S2 and molecular weight 433.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-benzylideneamino]-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine
Also Known As: VU0604955-1, (E)-N1-benzylidene-3-(thiophen-2-ylsulfonyl)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine, F3225-5790, (1E)-N1-(phenylmethylidene)-3-(thiophene-2-sulfonyl)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine, 1-[(E)-benzylideneamino]-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine
| Molecular Formula | C21H15N5O2S2 |
|---|---|
| Molecular Weight | 433.07 g/mol |
| LogP | 3.9432 |
| Topological Polar Surface Area | 103.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 433.0667 |
| Heavy Atoms | 30 |
| Complexity | 1505.9055 |
Chemical Identifiers
| CAS Number | 845652-43-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=N/N2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=CC=CS5)N |
Product Overview
VU0604955-1 (CAS 845652-43-9), with molecular formula C21H15N5O2S2 and molecular weight 433.07 g/mol. IUPAC: 1-[(E)-benzylideneamino]-3-thiophen-2-ylsulfonylpyrrolo[3,2-b]quinoxalin-2-amine.
Chemical Property Profile of VU0604955-1
Property Insights of VU0604955-1
The XLogP value of 3.9432 indicates that VU0604955-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.23 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0604955-1. Following Lipinski's Rule of Five, VU0604955-1 has 1 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 VU0604955-1?
The CAS number of VU0604955-1 is 845652-43-9.
What is the molecular formula of VU0604955-1?
The molecular formula of VU0604955-1 is C21H15N5O2S2.
What is the molecular weight of VU0604955-1?
The molecular weight of VU0604955-1 is 433.07 g/mol.
Where can I buy VU0604955-1?
You can request a quote for VU0604955-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0604955-1?
Yes, KEHONG BIO provides custom synthesis services for VU0604955-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.