![(Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide structure](/static/products/845/845802-33-7.png)
(Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide
TL;DR: (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide (CAS 845802-33-7) is a chemical compound with molecular formula C24H21N5O3 and molecular weight 427.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-cyano-7-(2-methoxyethyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-3-methylbenzamide
Also Known As: (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide, N-[(2Z)-3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-3-methylbenzamide
| Molecular Formula | C24H21N5O3 |
|---|---|
| Molecular Weight | 427.16 g/mol |
| LogP | 2.52522 |
| Topological Polar Surface Area | 101.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.16443 |
| Heavy Atoms | 32 |
| Complexity | 1540.084 |
Chemical Identifiers
| CAS Number | 845802-33-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)N=C2C(=CC3=C(N2CCOC)N=C4C(=CC=CN4C3=O)C)C#N |
Product Overview
(Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide (CAS 845802-33-7), with molecular formula C24H21N5O3 and molecular weight 427.16 g/mol. IUPAC: N-[5-cyano-7-(2-methoxyethyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-3-methylbenzamide.
Chemical Property Profile of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide
Property Insights of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide
The XLogP value of 2.52522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide. The TPSA of 101.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide. Following Lipinski's Rule of Five, (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide has 0 hydrogen bond donor(s) and 5 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 (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide?
The CAS number of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide is 845802-33-7.
What is the molecular formula of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide?
The molecular formula of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide is C24H21N5O3.
What is the molecular weight of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide?
The molecular weight of (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide is 427.16 g/mol.
Where can I buy (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide?
You can request a quote for (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3-cyano-1-(2-methoxyethyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.