A4106/0175101
TL;DR: A4106/0175101 (CAS 880068-35-9) is a chemical compound with molecular formula C22H24N2O6 and molecular weight 412.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-(3,4-dimethoxyphenyl)-4,7-dioxo-2,3,6,8,9,10-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylate
Also Known As: A4106/0175101, methyl 6-(3,4-dimethoxyphenyl)-4,7-dioxo-2,3,4,6,7,8,9,10-octahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylate, METHYL 6-(3,4-DIMETHOXYPHENYL)-4,7-DIOXO-1H,2H,3H,4H,6H,7H,8H,9H,10H-PYRAZINO[1,2-A]QUINOLINE-5-CARBOXYLATE, methyl 6-(3,4-dimethoxyphenyl)-4,7-dioxo-2,3,6,8,9,10-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylate
| Molecular Formula | C22H24N2O6 |
|---|---|
| Molecular Weight | 412.16 g/mol |
| LogP | 1.667 |
| Topological Polar Surface Area | 94.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.16342 |
| Heavy Atoms | 30 |
| Complexity | 993.3419 |
Chemical Identifiers
| CAS Number | 880068-35-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C3=C(CCCC3=O)N4CCNC(=O)C4=C2C(=O)OC)OC |
Product Overview
A4106/0175101 (CAS 880068-35-9), with molecular formula C22H24N2O6 and molecular weight 412.16 g/mol. IUPAC: methyl 6-(3,4-dimethoxyphenyl)-4,7-dioxo-2,3,6,8,9,10-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxylate.
Chemical Property Profile of A4106/0175101
Property Insights of A4106/0175101
The XLogP value of 1.667 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A4106/0175101. The TPSA of 94.17 Ų falls within the moderate polarity range, balancing permeability and solubility for A4106/0175101. Following Lipinski's Rule of Five, A4106/0175101 has 1 hydrogen bond donor(s) and 7 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 A4106/0175101?
The CAS number of A4106/0175101 is 880068-35-9.
What is the molecular formula of A4106/0175101?
The molecular formula of A4106/0175101 is C22H24N2O6.
What is the molecular weight of A4106/0175101?
The molecular weight of A4106/0175101 is 412.16 g/mol.
Where can I buy A4106/0175101?
You can request a quote for A4106/0175101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4106/0175101?
Yes, KEHONG BIO provides custom synthesis services for A4106/0175101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.