VU0604894-1
TL;DR: VU0604894-1 (CAS 836635-81-5) is a chemical compound with molecular formula C23H22N6O4 and molecular weight 446.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[2-amino-3-(2-methoxyethylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]iminomethyl]benzoate
Also Known As: VU0604894-1, (E)-methyl 4-(((2-amino-3-((2-methoxyethyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)imino)methyl)benzoate, F3225-5064, methyl 4-[(1E)-({2-amino-3-[(2-methoxyethyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}imino)methyl]benzoate, methyl 4-[(E)-({2-amino-3-[(2-methoxyethyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}imino)methyl]benzoate
| Molecular Formula | C23H22N6O4 |
|---|---|
| Molecular Weight | 446.17 g/mol |
| LogP | 2.2117 |
| Topological Polar Surface Area | 133.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 446.17026 |
| Heavy Atoms | 33 |
| Complexity | 1361.1525 |
Chemical Identifiers
| CAS Number | 836635-81-5 |
|---|---|
| SMILES | COCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CC=C(C=C4)C(=O)OC)N |
Product Overview
VU0604894-1 (CAS 836635-81-5), with molecular formula C23H22N6O4 and molecular weight 446.17 g/mol. IUPAC: methyl 4-[(E)-[2-amino-3-(2-methoxyethylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]iminomethyl]benzoate.
Chemical Property Profile of VU0604894-1
Property Insights of VU0604894-1
The XLogP value of 2.2117 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0604894-1. The TPSA of 133.72 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0604894-1. Following Lipinski's Rule of Five, VU0604894-1 has 2 hydrogen bond donor(s) and 8 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 VU0604894-1?
The CAS number of VU0604894-1 is 836635-81-5.
What is the molecular formula of VU0604894-1?
The molecular formula of VU0604894-1 is C23H22N6O4.
What is the molecular weight of VU0604894-1?
The molecular weight of VU0604894-1 is 446.17 g/mol.
Where can I buy VU0604894-1?
You can request a quote for VU0604894-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0604894-1?
Yes, KEHONG BIO provides custom synthesis services for VU0604894-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.