N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide
TL;DR: N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide (CAS 587008-91-1) is a chemical compound with molecular formula C24H28N4O5S and molecular weight 484.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethoxyphenyl)-2-[(6-ethyl-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl)sulfanyl]acetamide
Also Known As: N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide, N-(2,4-dimethoxyphenyl)-2-((3-ethyl-8,8-dimethyl-4-oxo-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)acetamide, N-(2,4-dimethoxyphenyl)-2-[(3-ethyl-8,8-dimethyl-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
| Molecular Formula | C24H28N4O5S |
|---|---|
| Molecular Weight | 484.18 g/mol |
| LogP | 3.4107 |
| Topological Polar Surface Area | 104.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.17804 |
| Heavy Atoms | 34 |
| Complexity | 1304.7434 |
Chemical Identifiers
| CAS Number | 587008-91-1 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C3CC(OCC3=C2)(C)C)N=C1SCC(=O)NC4=C(C=C(C=C4)OC)OC |
Product Overview
N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide (CAS 587008-91-1), with molecular formula C24H28N4O5S and molecular weight 484.18 g/mol. IUPAC: N-(2,4-dimethoxyphenyl)-2-[(6-ethyl-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl)sulfanyl]acetamide.
Chemical Property Profile of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide
Property Insights of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide
The XLogP value of 3.4107 indicates that N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.57 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide. Following Lipinski's Rule of Five, N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide has 1 hydrogen bond donor(s) and 8 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 N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide?
The CAS number of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide is 587008-91-1.
What is the molecular formula of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide?
The molecular formula of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide is C24H28N4O5S.
What is the molecular weight of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide?
The molecular weight of N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide is 484.18 g/mol.
Where can I buy N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide?
You can request a quote for N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dimethoxy-phenyl)-2-(3-ethyl-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthra cen-2-ylsulfanyl)-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.