![N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide structure](/static/products/116/1164461-18-0.png)
N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide
TL;DR: N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide (CAS 1164461-18-0) is a chemical compound with molecular formula C27H27N5O5 and molecular weight 501.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-cyano-7-(3-ethoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-3,4-dimethoxybenzamide
Also Known As: N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide, (E)-N-(3-cyano-1-(3-ethoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3,4-dimethoxybenzamide, N-[(2E)-3-cyano-1-(3-ethoxypropyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-3,4-dimethoxybenzamide, N-[3-cyano-1-(3-ethoxypropyl)-10-methyl-5-oxidanylidene-dipyrido[3,4-c:1'',2''-f]pyrimidin-2-ylidene]-3,4-dimethoxy-benzamide, N-[3-cyano-1-(3-ethoxypropyl)-10-methyl-5-oxo-2-dipyrido[3,4-c:1'',2''-f]pyrimidinylidene]-3,4-dimethoxybenzamide
| Molecular Formula | C27H27N5O5 |
|---|---|
| Molecular Weight | 501.20 g/mol |
| LogP | 3.0142 |
| Topological Polar Surface Area | 120.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 501.20123 |
| Heavy Atoms | 37 |
| Complexity | 1662.8986 |
Chemical Identifiers
| CAS Number | 1164461-18-0 |
|---|---|
| SMILES | CCOCCCN1C2=C(C=C(C1=NC(=O)C3=CC(=C(C=C3)OC)OC)C#N)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide (CAS 1164461-18-0), with molecular formula C27H27N5O5 and molecular weight 501.20 g/mol. IUPAC: N-[5-cyano-7-(3-ethoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-3,4-dimethoxybenzamide.
Chemical Property Profile of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide
Property Insights of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide
The XLogP value of 3.0142 indicates that N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.21 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide. Following Lipinski's Rule of Five, N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide?
The CAS number of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide is 1164461-18-0.
What is the molecular formula of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide?
The molecular formula of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide is C27H27N5O5.
What is the molecular weight of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide?
The molecular weight of N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide is 501.20 g/mol.
Where can I buy N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide?
You can request a quote for N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-Cyano-1-(3-ethoxy-propyl)-8-methyl-10-oxo-1,10-dihydro-1,9,10a-triaza-anthracen-(2E)-ylidene]-3 ,4-dimethoxy-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.