VU0611594-1
TL;DR: VU0611594-1 (CAS 900873-83-8) is a chemical compound with molecular formula C20H24N4O5 and molecular weight 400.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[6-(3-methoxypropyl)-10-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carbonyl]amino]acetate
Also Known As: VU0611594-1, F3345-0397, ethyl 2-(1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamido)acetate, ethyl 2-{[6-(3-methoxypropyl)-10-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.0^{3,7}]trideca-3(7),4,8,10,12-pentaen-5-yl]formamido}acetate, ethyl 2-[[6-(3-methoxypropyl)-10-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carbonyl]amino]acetate
| Molecular Formula | C20H24N4O5 |
|---|---|
| Molecular Weight | 400.17 g/mol |
| LogP | 1.28702 |
| Topological Polar Surface Area | 103.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 400.17468 |
| Heavy Atoms | 29 |
| Complexity | 1115.4407 |
Chemical Identifiers
| CAS Number | 900873-83-8 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C1=CC2=C(N1CCCOC)N=C3C(=CC=CN3C2=O)C |
Product Overview
VU0611594-1 (CAS 900873-83-8), with molecular formula C20H24N4O5 and molecular weight 400.17 g/mol. IUPAC: ethyl 2-[[6-(3-methoxypropyl)-10-methyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carbonyl]amino]acetate.
Chemical Property Profile of VU0611594-1
Property Insights of VU0611594-1
The XLogP value of 1.28702 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0611594-1. The TPSA of 103.93 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0611594-1. Following Lipinski's Rule of Five, VU0611594-1 has 1 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 VU0611594-1?
The CAS number of VU0611594-1 is 900873-83-8.
What is the molecular formula of VU0611594-1?
The molecular formula of VU0611594-1 is C20H24N4O5.
What is the molecular weight of VU0611594-1?
The molecular weight of VU0611594-1 is 400.17 g/mol.
Where can I buy VU0611594-1?
You can request a quote for VU0611594-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0611594-1?
Yes, KEHONG BIO provides custom synthesis services for VU0611594-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.