2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
TL;DR: 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide (CAS 844454-84-8) is a chemical compound with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-imino-7-(2-methoxyethyl)-2-oxo-N-(2-piperidin-1-ylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide, 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-(piperidin-1-yl)ethyl)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 2-imino-1-(2-methoxyethyl)-5-oxo-N-[2-(piperidin-1-yl)ethyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 2-IMINO-1-(2-METHOXYETHYL)-5-OXO-N~3~-(2-PIPERIDINOETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE
| Molecular Formula | C22H28N6O3 |
|---|---|
| Molecular Weight | 424.22 g/mol |
| LogP | 0.99077 |
| Topological Polar Surface Area | 104.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.2223 |
| Heavy Atoms | 31 |
| Complexity | 1209.5464 |
Chemical Identifiers
| CAS Number | 844454-84-8 |
|---|---|
| SMILES | COCCN1C2=C(C=C(C1=N)C(=O)NCCN3CCCCC3)C(=O)N4C=CC=CC4=N2 |
Product Overview
2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide (CAS 844454-84-8), with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol. IUPAC: 6-imino-7-(2-methoxyethyl)-2-oxo-N-(2-piperidin-1-ylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
Property Insights of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide
The XLogP value of 0.99077 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide. The TPSA of 104.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide. Following Lipinski's Rule of Five, 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide 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 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide?
The CAS number of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide is 844454-84-8.
What is the molecular formula of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide?
The molecular formula of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide is C22H28N6O3.
What is the molecular weight of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide?
The molecular weight of 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide is 424.22 g/mol.
Where can I buy 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide?
You can request a quote for 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-imino-1-(2-methoxyethyl)-5-oxo-N-(2-piperidinoethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.