VU0604889-1
TL;DR: VU0604889-1 (CAS 836635-64-4) is a chemical compound with molecular formula C21H21N7O and molecular weight 387.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-(2-methylpropyl)-1-[(E)-pyridin-3-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: VU0604889-1, (E)-2-amino-N-isobutyl-1-((pyridin-3-ylmethylene)amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-N-(2-methylpropyl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-N-(2-methylpropyl)-1-[(E)-pyridin-3-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide, 2-amino-N-(2-methylpropyl)-1-{[(E)-pyridin-3-ylmethylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
| Molecular Formula | C21H21N7O |
|---|---|
| Molecular Weight | 387.18 g/mol |
| LogP | 2.8297 |
| Topological Polar Surface Area | 111.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.18076 |
| Heavy Atoms | 29 |
| Complexity | 1212.1455 |
Chemical Identifiers
| CAS Number | 836635-64-4 |
|---|---|
| SMILES | CC(C)CNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CN=CC=C4)N |
Product Overview
VU0604889-1 (CAS 836635-64-4), with molecular formula C21H21N7O and molecular weight 387.18 g/mol. IUPAC: 2-amino-N-(2-methylpropyl)-1-[(E)-pyridin-3-ylmethylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of VU0604889-1
Property Insights of VU0604889-1
The XLogP value of 2.8297 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0604889-1. The TPSA of 111.08 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0604889-1. Following Lipinski's Rule of Five, VU0604889-1 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 VU0604889-1?
The CAS number of VU0604889-1 is 836635-64-4.
What is the molecular formula of VU0604889-1?
The molecular formula of VU0604889-1 is C21H21N7O.
What is the molecular weight of VU0604889-1?
The molecular weight of VU0604889-1 is 387.18 g/mol.
Where can I buy VU0604889-1?
You can request a quote for VU0604889-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0604889-1?
Yes, KEHONG BIO provides custom synthesis services for VU0604889-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.