2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid
TL;DR: 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid (CAS 73507-55-8) is a chemical compound with molecular formula C41H30N6O8 and molecular weight 734.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid
Also Known As: 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid, 9,10-Anthracenedione, 2-acetyl-4-((4-((3-acetyl-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-6-phenyl-1,3,5-triazin-2-yl)amino)-1-amino-
| Molecular Formula | C41H30N6O8 |
|---|---|
| Molecular Weight | 734.21 g/mol |
| LogP | 5.251 |
| Topological Polar Surface Area | 231.63 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 734.2125 |
| Heavy Atoms | 55 |
| Complexity | 2520.9553 |
Chemical Identifiers
| CAS Number | 73507-55-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=NC(=N2)NC3=CC(=C[C@H]4[C@H]3C(=O)C5=CC=CC=C5C4=O)CC(=O)O)NC6=C7C(=O)[C@@H]8C=CC=C[C@H]8C(=O)C7=C(C(=C6)CC(=O)O)N |
Product Overview
2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid (CAS 73507-55-8), with molecular formula C41H30N6O8 and molecular weight 734.21 g/mol. IUPAC: 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid.
Chemical Property Profile of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid
Property Insights of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid
The XLogP value of 5.251 indicates that 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 231.63 Ų indicates high polarity, suggesting 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid?
The CAS number of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid is 73507-55-8.
What is the molecular formula of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid?
The molecular formula of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid is C41H30N6O8.
What is the molecular weight of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid?
The molecular weight of 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid is 734.21 g/mol.
Where can I buy 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid?
You can request a quote for 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4aR,9aS)-4-[[4-[[(8aR,10aR)-4-amino-3-(carboxymethyl)-9,10-dioxo-8a,10a-dihydroanthracen-1-yl]amino]-6-phenyl-1,3,5-triazin-2-yl]amino]-9,10-dioxo-4a,9a-dihydroanthracen-2-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.