RefChem:273013
TL;DR: RefChem:273013 (CAS 2459-82-7) is a chemical compound with molecular formula C45H21N3O4 and molecular weight 667.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
25-[(9,10-dioxoanthracen-1-yl)amino]-2,33-diazanonacyclo[18.10.2.12,5.03,16.04,13.06,11.017,31.022,27.028,32]tritriaconta-1(30),3(16),4(13),5(33),6,9,11,14,17(31),18,20(32),21,23,25,27-pentadecaene-8,29-dione
Also Known As: EINECS 219-548-9, 3-((9,10-Dioxo-9,10-dihydro-1-anthryl)amino)-5,10-dihydroanthra(2,1,9-mna)benz(6,7)indazolo(2,3,4-fgh)acridine-5,10-dione, 3-(1-Anthrachinonylamino)-anthra<2,1,9-mna>benz<6,7>indazolo<2,3,4-fgh>acridin-5,10-dion, 2-[(9,10-Dioxo-9,10-dihydroanthracen-1-yl)amino]anthra[2,1,9-mna]benzo[6,7]indazolo[2,3,4-fgh]acridine-13,18-dione, 219-548-9
| Molecular Formula | C45H21N3O4 |
|---|---|
| Molecular Weight | 667.15 g/mol |
| LogP | 8.9595 |
| Topological Polar Surface Area | 97.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 667.1532 |
| Heavy Atoms | 52 |
| Complexity | 3584.6877 |
Chemical Identifiers
| CAS Number | 2459-82-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC5=C6C(=O)C=C7C8=C(C=CC(=C86)C=C5C=C4)C9=C1N7N=C2C1=C(C=C9)C=C1C2=CC(=O)C=C1 |
Product Overview
RefChem:273013 (CAS 2459-82-7), with molecular formula C45H21N3O4 and molecular weight 667.15 g/mol. IUPAC: 25-[(9,10-dioxoanthracen-1-yl)amino]-2,33-diazanonacyclo[18.10.2.12,5.03,16.04,13.06,11.017,31.022,27.028,32]tritriaconta-1(30),3(16),4(13),5(33),6,9,11,14,17(31),18,20(32),21,23,25,27-pentadecaene-8,29-dione.
Chemical Property Profile of RefChem:273013
Property Insights of RefChem:273013
The XLogP value of 8.9595 indicates that RefChem:273013 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.61 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:273013. Following Lipinski's Rule of Five, RefChem:273013 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:273013?
The CAS number of RefChem:273013 is 2459-82-7.
What is the molecular formula of RefChem:273013?
The molecular formula of RefChem:273013 is C45H21N3O4.
What is the molecular weight of RefChem:273013?
The molecular weight of RefChem:273013 is 667.15 g/mol.
Where can I buy RefChem:273013?
You can request a quote for RefChem:273013 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:273013?
Yes, KEHONG BIO provides custom synthesis services for RefChem:273013 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.