VU0606774-1
TL;DR: VU0606774-1 (CAS 899414-90-5) is a chemical compound with molecular formula C25H30N6O4 and molecular weight 478.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4,7-dimethyl-1,3-dioxo-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazol-6-yl]benzoate
Also Known As: VU0606774-1, F3235-1332, ethyl 4-[4,7-dimethyl-1,3-dioxo-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazol-6-yl]benzoate, ethyl 4-[1,7-dimethyl-2,4-dioxo-3-(2-piperidylethyl)-1,3,5-trihydro-4-imidazol ino[1,2-h]purin-8-yl]benzoate, ethyl 4-(1,7-dimethyl-2,4-dioxo-3-(2-(piperidin-1-yl)ethyl)-3,4-dihydro-1H-imidazo[2,1-f]purin-8(2H)-yl)benzoate
| Molecular Formula | C25H30N6O4 |
|---|---|
| Molecular Weight | 478.23 g/mol |
| LogP | 2.10962 |
| Topological Polar Surface Area | 95.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.23285 |
| Heavy Atoms | 35 |
| Complexity | 1516.3436 |
Chemical Identifiers
| CAS Number | 899414-90-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCN5CCCCC5)C |
Product Overview
VU0606774-1 (CAS 899414-90-5), with molecular formula C25H30N6O4 and molecular weight 478.23 g/mol. IUPAC: ethyl 4-[4,7-dimethyl-1,3-dioxo-2-(2-piperidin-1-ylethyl)purino[7,8-a]imidazol-6-yl]benzoate.
Chemical Property Profile of VU0606774-1
Property Insights of VU0606774-1
The XLogP value of 2.10962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0606774-1. The TPSA of 95.77 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0606774-1. Following Lipinski's Rule of Five, VU0606774-1 has 0 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 VU0606774-1?
The CAS number of VU0606774-1 is 899414-90-5.
What is the molecular formula of VU0606774-1?
The molecular formula of VU0606774-1 is C25H30N6O4.
What is the molecular weight of VU0606774-1?
The molecular weight of VU0606774-1 is 478.23 g/mol.
Where can I buy VU0606774-1?
You can request a quote for VU0606774-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0606774-1?
Yes, KEHONG BIO provides custom synthesis services for VU0606774-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.