VU0604885-1
TL;DR: VU0604885-1 (CAS 836650-43-2) is a chemical compound with molecular formula C20H20N6OS and molecular weight 392.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-butyl-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: VU0604885-1, (E)-2-amino-N-butyl-1-((thiophen-2-ylmethylene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, F3225-5003, 2-amino-N-butyl-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide, 2-amino-N-butyl-1-[(E)-[(thiophen-2-yl)methylidene]amino]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
| Molecular Formula | C20H20N6OS |
|---|---|
| Molecular Weight | 392.14 g/mol |
| LogP | 3.6403 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.14194 |
| Heavy Atoms | 28 |
| Complexity | 1162.5938 |
Chemical Identifiers
| CAS Number | 836650-43-2 |
|---|---|
| SMILES | CCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CC=CS4)N |
Product Overview
VU0604885-1 (CAS 836650-43-2), with molecular formula C20H20N6OS and molecular weight 392.14 g/mol. IUPAC: 2-amino-N-butyl-1-[(E)-thiophen-2-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of VU0604885-1
Property Insights of VU0604885-1
The XLogP value of 3.6403 indicates that VU0604885-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.19 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0604885-1. Following Lipinski's Rule of Five, VU0604885-1 has 2 hydrogen bond donor(s) and 6 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 VU0604885-1?
The CAS number of VU0604885-1 is 836650-43-2.
What is the molecular formula of VU0604885-1?
The molecular formula of VU0604885-1 is C20H20N6OS.
What is the molecular weight of VU0604885-1?
The molecular weight of VU0604885-1 is 392.14 g/mol.
Where can I buy VU0604885-1?
You can request a quote for VU0604885-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0604885-1?
Yes, KEHONG BIO provides custom synthesis services for VU0604885-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.