1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE
TL;DR: 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE (CAS 879925-24-3) is a chemical compound with molecular formula C23H20N4O4 and molecular weight 416.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-(3,4-dimethoxyphenyl)ethyl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Also Known As: 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE, 1-(3,4-dimethoxyphenethyl)-10-methyl-2,5-dioxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile, 1-[2-(3,4-Dimethoxy-phenyl)-ethyl]-8-methyl-2,10-dioxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-c arbonitrile, 1-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile, 1-[2-(3,4-dimethoxyphenyl)ethyl]-10-methyl-2,5-dioxo-1,6-dihydropyridino[2,3-d ]pyridino[1,2-a]pyrimidine-3-carbonitrile
| Molecular Formula | C23H20N4O4 |
|---|---|
| Molecular Weight | 416.15 g/mol |
| LogP | 2.4494 |
| Topological Polar Surface Area | 98.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.14847 |
| Heavy Atoms | 31 |
| Complexity | 1477.9409 |
Chemical Identifiers
| CAS Number | 879925-24-3 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=O)N3CCC4=CC(=C(C=C4)OC)OC)C#N |
Product Overview
1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE (CAS 879925-24-3), with molecular formula C23H20N4O4 and molecular weight 416.15 g/mol. IUPAC: 7-[2-(3,4-dimethoxyphenyl)ethyl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile.
Chemical Property Profile of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE
Property Insights of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE
The XLogP value of 2.4494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE. The TPSA of 98.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE. Following Lipinski's Rule of Five, 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE 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 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE?
The CAS number of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE is 879925-24-3.
What is the molecular formula of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE?
The molecular formula of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE is C23H20N4O4.
What is the molecular weight of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE?
The molecular weight of 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE is 416.15 g/mol.
Where can I buy 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE?
You can request a quote for 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-DIMETHOXYPHENETHYL)-10-METHYL-2,5-DIOXO-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDIN-3-YL CYANIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.