VU0604741-1
TL;DR: VU0604741-1 (CAS 848685-22-3) is a chemical compound with molecular formula C21H20N4O3S and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 2-amino-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: VU0604741-1, (tetrahydrofuran-2-yl)methyl 2-amino-1-(thiophen-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, (oxolan-2-yl)methyl 2-amino-1-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, oxolan-2-ylmethyl 2-amino-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate, (perhydro-2-furyl)methyl 5-amino-4-thenyl-2,4,8-triazatricyclo[7.4.0.0(3),]trideca-1(9),2,5,7,10,12-hexaene-6-carboxylate
| Molecular Formula | C21H20N4O3S |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.1256 |
| Heavy Atoms | 29 |
| Complexity | 596.0 |
Chemical Identifiers
| CAS Number | 848685-22-3 |
|---|---|
| SMILES | C1CC(OC1)COC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CS5)N |
| InChIKey | KPVVUCIVCZMKDY-UHFFFAOYSA-N |
Product Overview
VU0604741-1 (CAS 848685-22-3), with molecular formula C21H20N4O3S and molecular weight 408.13 g/mol. IUPAC: oxolan-2-ylmethyl 2-amino-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of VU0604741-1
Property Insights of VU0604741-1
The XLogP value of 3.5 indicates that VU0604741-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0604741-1. Following Lipinski's Rule of Five, VU0604741-1 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 VU0604741-1?
The CAS number of VU0604741-1 is 848685-22-3.
What is the molecular formula of VU0604741-1?
The molecular formula of VU0604741-1 is C21H20N4O3S.
What is the molecular weight of VU0604741-1?
The molecular weight of VU0604741-1 is 408.13 g/mol.
Where can I buy VU0604741-1?
You can request a quote for VU0604741-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0604741-1?
Yes, KEHONG BIO provides custom synthesis services for VU0604741-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.