VU0604902-1
TL;DR: VU0604902-1 (CAS 839699-15-9) is a chemical compound with molecular formula C22H22N6O2 and molecular weight 402.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-[(E)-benzylideneamino]-N-(3-methoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: VU0604902-1, (E)-2-amino-1-(benzylideneamino)-N-(3-methoxypropyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, F3225-5079, 2-amino-N-(3-methoxypropyl)-1-[(E)-(phenylmethylidene)amino]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-[(E)-benzylideneamino]-N-(3-methoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
| Molecular Formula | C22H22N6O2 |
|---|---|
| Molecular Weight | 402.18 g/mol |
| LogP | 2.8152 |
| Topological Polar Surface Area | 107.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 402.18042 |
| Heavy Atoms | 30 |
| Complexity | 1216.7437 |
Chemical Identifiers
| CAS Number | 839699-15-9 |
|---|---|
| SMILES | COCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CC=CC=C4)N |
Product Overview
VU0604902-1 (CAS 839699-15-9), with molecular formula C22H22N6O2 and molecular weight 402.18 g/mol. IUPAC: 2-amino-1-[(E)-benzylideneamino]-N-(3-methoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of VU0604902-1
Property Insights of VU0604902-1
The XLogP value of 2.8152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0604902-1. The TPSA of 107.42 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0604902-1. Following Lipinski's Rule of Five, VU0604902-1 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 VU0604902-1?
The CAS number of VU0604902-1 is 839699-15-9.
What is the molecular formula of VU0604902-1?
The molecular formula of VU0604902-1 is C22H22N6O2.
What is the molecular weight of VU0604902-1?
The molecular weight of VU0604902-1 is 402.18 g/mol.
Where can I buy VU0604902-1?
You can request a quote for VU0604902-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0604902-1?
Yes, KEHONG BIO provides custom synthesis services for VU0604902-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.